USER MOD reduce.3.24.130724 H: found=0, std=0, add=998, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 998 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 HIS : no HD1:sc= 0.239 K(o=0.18,f=-3!) USER MOD Set 1.2: A 63 SER OG : rot -162:sc= -0.0546 USER MOD Set 2.1: A 59 GLN : amide:sc= 1.02 K(o=1.9,f=1.1) USER MOD Set 2.2: A 62 SER OG : rot 180:sc= 0.88 USER MOD Set 3.1: A 47 THR OG1 : rot 170:sc= -0.463 USER MOD Set 3.2: A 71 GLN : amide:sc= 0 K(o=-0.46,f=-1.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 157:sc= 0.49 (180deg=-4.15e-05!) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.0063 X(o=-0.0063,f=0) USER MOD Single : A 5 HIS : no HE2:sc= 0.328 K(o=0.33,f=-2.1!) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=-0.0088) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.064) USER MOD Single : A 9 MET CE :methyl 160:sc= -0.135 (180deg=-0.774) USER MOD Single : A 11 THR OG1 : rot 39:sc= 0.246 USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0252 USER MOD Single : A 17 GLN : amide:sc= -0.0406 X(o=-0.041,f=-0.48) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 180:sc= -0.0633 USER MOD Single : A 25 GLN : amide:sc= 1.57 K(o=1.6,f=-2.6!) USER MOD Single : A 28 LYS NZ :NH3+ -166:sc= -0.0287 (180deg=-0.259) USER MOD Single : A 29 LYS NZ :NH3+ -166:sc= 0.968 (180deg=0.841) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -99:sc= 0.685 USER MOD Single : A 39 LYS NZ :NH3+ -161:sc= -0.102 (180deg=-0.458) USER MOD Single : A 41 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 44 LYS NZ :NH3+ -124:sc= -0.334 (180deg=-1.79!) USER MOD Single : A 45 LYS NZ :NH3+ 165:sc= -0.0783 (180deg=-0.376) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 142:sc= -0.639 (180deg=-1.79!) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ -172:sc=-0.00894 (180deg=-0.121) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ -173:sc= 0.456 (180deg=0.173) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 89 THR OG1 : rot -31:sc= 0.108 USER MOD Single : A 90 MET CE :methyl -111:sc= -3.3 (180deg=-4.06) USER MOD Single : A 91 THR OG1 : rot -51:sc= 0.195 USER MOD Single : A 95 LYS NZ :NH3+ 151:sc= 1.2 (180deg=-0.614!) USER MOD Single : A 99 THR OG1 : rot 67:sc= 1.29 USER MOD Single : A 102 TYR OH : rot -149:sc= 1.2 USER MOD Single : A 103 GLN : amide:sc= -0.161 K(o=-0.16,f=-1.2) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot -15:sc= 0.564 USER MOD Single : A 118 LYS NZ :NH3+ -141:sc= 1.01 (180deg=-1.07) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 25.313 -37.729 -22.561 1.00 3.40 N ATOM 2 CA MET A 1 23.860 -37.580 -22.803 1.00 10.21 C ATOM 3 C MET A 1 23.545 -36.151 -23.227 1.00 31.33 C ATOM 4 O MET A 1 23.930 -35.196 -22.545 1.00 3.30 O ATOM 5 CB MET A 1 23.056 -37.938 -21.543 1.00 73.31 C ATOM 6 CG MET A 1 23.267 -39.368 -21.056 1.00 65.15 C ATOM 7 SD MET A 1 24.980 -39.696 -20.588 1.00 4.42 S ATOM 8 CE MET A 1 24.833 -41.344 -19.895 1.00 65.21 C ATOM 0 H1 MET A 1 25.478 -38.534 -21.924 1.00 3.40 H new ATOM 0 H2 MET A 1 25.800 -37.897 -23.464 1.00 3.40 H new ATOM 0 H3 MET A 1 25.683 -36.861 -22.124 1.00 3.40 H new ATOM 0 HA MET A 1 23.575 -38.265 -23.602 1.00 10.21 H new ATOM 0 HB2 MET A 1 23.328 -37.249 -20.743 1.00 73.31 H new ATOM 0 HB3 MET A 1 21.996 -37.787 -21.746 1.00 73.31 H new ATOM 0 HG2 MET A 1 22.618 -39.556 -20.201 1.00 65.15 H new ATOM 0 HG3 MET A 1 22.969 -40.063 -21.841 1.00 65.15 H new ATOM 0 HE1 MET A 1 25.812 -41.686 -19.560 1.00 65.21 H new ATOM 0 HE2 MET A 1 24.147 -41.323 -19.049 1.00 65.21 H new ATOM 0 HE3 MET A 1 24.451 -42.026 -20.655 1.00 65.21 H new ATOM 20 N ALA A 2 22.854 -36.010 -24.356 1.00 11.55 N ATOM 21 CA ALA A 2 22.473 -34.703 -24.876 1.00 5.04 C ATOM 22 C ALA A 2 21.452 -34.861 -25.997 1.00 60.10 C ATOM 23 O ALA A 2 21.630 -35.682 -26.900 1.00 53.10 O ATOM 24 CB ALA A 2 23.699 -33.943 -25.377 1.00 52.24 C ATOM 0 H ALA A 2 22.545 -36.794 -24.931 1.00 11.55 H new ATOM 0 HA ALA A 2 22.022 -34.128 -24.068 1.00 5.04 H new ATOM 0 HB1 ALA A 2 23.392 -32.970 -25.761 1.00 52.24 H new ATOM 0 HB2 ALA A 2 24.402 -33.804 -24.555 1.00 52.24 H new ATOM 0 HB3 ALA A 2 24.180 -34.512 -26.173 1.00 52.24 H new ATOM 30 N HIS A 3 20.371 -34.093 -25.926 1.00 21.32 N ATOM 31 CA HIS A 3 19.344 -34.106 -26.964 1.00 71.41 C ATOM 32 C HIS A 3 19.213 -32.725 -27.596 1.00 74.23 C ATOM 33 O HIS A 3 18.514 -31.856 -27.063 1.00 21.43 O ATOM 34 CB HIS A 3 17.983 -34.544 -26.396 1.00 10.53 C ATOM 35 CG HIS A 3 17.965 -35.931 -25.832 1.00 12.00 C ATOM 36 ND1 HIS A 3 17.943 -37.066 -26.615 1.00 64.50 N ATOM 37 CD2 HIS A 3 17.946 -36.363 -24.551 1.00 70.35 C ATOM 38 CE1 HIS A 3 17.906 -38.131 -25.839 1.00 44.42 C ATOM 39 NE2 HIS A 3 17.907 -37.732 -24.584 1.00 50.14 N ATOM 0 H HIS A 3 20.182 -33.450 -25.157 1.00 21.32 H new ATOM 0 HA HIS A 3 19.649 -34.825 -27.724 1.00 71.41 H new ATOM 0 HB2 HIS A 3 17.687 -33.844 -25.615 1.00 10.53 H new ATOM 0 HB3 HIS A 3 17.235 -34.476 -27.186 1.00 10.53 H new ATOM 0 HD2 HIS A 3 17.959 -35.744 -23.666 1.00 70.35 H new ATOM 0 HE1 HIS A 3 17.879 -39.157 -26.175 1.00 44.42 H new ATOM 0 HE2 HIS A 3 17.883 -38.344 -23.768 1.00 50.14 H new ATOM 48 N HIS A 4 19.902 -32.517 -28.717 1.00 41.44 N ATOM 49 CA HIS A 4 19.789 -31.267 -29.463 1.00 61.42 C ATOM 50 C HIS A 4 18.398 -31.190 -30.082 1.00 34.24 C ATOM 51 O HIS A 4 18.187 -31.587 -31.231 1.00 73.23 O ATOM 52 CB HIS A 4 20.880 -31.170 -30.545 1.00 70.34 C ATOM 53 CG HIS A 4 20.887 -29.868 -31.291 1.00 12.14 C ATOM 54 ND1 HIS A 4 21.726 -28.823 -30.970 1.00 24.54 N ATOM 55 CD2 HIS A 4 20.159 -29.446 -32.353 1.00 32.52 C ATOM 56 CE1 HIS A 4 21.513 -27.819 -31.797 1.00 45.00 C ATOM 57 NE2 HIS A 4 20.566 -28.169 -32.646 1.00 44.43 N ATOM 0 H HIS A 4 20.543 -33.197 -29.127 1.00 41.44 H new ATOM 0 HA HIS A 4 19.932 -30.425 -28.785 1.00 61.42 H new ATOM 0 HB2 HIS A 4 21.854 -31.314 -30.078 1.00 70.34 H new ATOM 0 HB3 HIS A 4 20.744 -31.984 -31.257 1.00 70.34 H new ATOM 0 HD2 HIS A 4 19.399 -30.010 -32.873 1.00 32.52 H new ATOM 0 HE1 HIS A 4 22.027 -26.869 -31.782 1.00 45.00 H new ATOM 0 HE2 HIS A 4 20.197 -27.586 -33.397 1.00 44.43 H new ATOM 66 N HIS A 5 17.448 -30.715 -29.287 1.00 33.34 N ATOM 67 CA HIS A 5 16.033 -30.745 -29.647 1.00 30.04 C ATOM 68 C HIS A 5 15.572 -29.404 -30.211 1.00 71.42 C ATOM 69 O HIS A 5 16.210 -28.372 -29.993 1.00 43.00 O ATOM 70 CB HIS A 5 15.195 -31.118 -28.416 1.00 43.53 C ATOM 71 CG HIS A 5 15.288 -30.129 -27.291 1.00 2.34 C ATOM 72 ND1 HIS A 5 16.250 -30.198 -26.302 1.00 73.32 N ATOM 73 CD2 HIS A 5 14.534 -29.041 -27.002 1.00 13.00 C ATOM 74 CE1 HIS A 5 16.078 -29.198 -25.454 1.00 45.42 C ATOM 75 NE2 HIS A 5 15.047 -28.482 -25.858 1.00 75.32 N ATOM 0 H HIS A 5 17.634 -30.298 -28.375 1.00 33.34 H new ATOM 0 HA HIS A 5 15.894 -31.497 -30.424 1.00 30.04 H new ATOM 0 HB2 HIS A 5 14.151 -31.215 -28.716 1.00 43.53 H new ATOM 0 HB3 HIS A 5 15.515 -32.095 -28.054 1.00 43.53 H new ATOM 0 HD1 HIS A 5 16.979 -30.909 -26.236 1.00 73.32 H new ATOM 0 HD2 HIS A 5 13.687 -28.681 -27.567 1.00 13.00 H new ATOM 0 HE1 HIS A 5 16.680 -29.001 -24.579 1.00 45.42 H new ATOM 84 N HIS A 6 14.453 -29.433 -30.925 1.00 63.13 N ATOM 85 CA HIS A 6 13.866 -28.229 -31.501 1.00 11.21 C ATOM 86 C HIS A 6 13.006 -27.515 -30.459 1.00 65.13 C ATOM 87 O HIS A 6 12.624 -28.103 -29.447 1.00 22.35 O ATOM 88 CB HIS A 6 13.008 -28.586 -32.722 1.00 13.32 C ATOM 89 CG HIS A 6 13.746 -29.335 -33.790 1.00 73.33 C ATOM 90 ND1 HIS A 6 13.726 -30.710 -33.894 1.00 11.11 N ATOM 91 CD2 HIS A 6 14.517 -28.895 -34.813 1.00 2.41 C ATOM 92 CE1 HIS A 6 14.451 -31.081 -34.931 1.00 15.55 C ATOM 93 NE2 HIS A 6 14.942 -30.001 -35.506 1.00 40.03 N ATOM 0 H HIS A 6 13.929 -30.286 -31.120 1.00 63.13 H new ATOM 0 HA HIS A 6 14.672 -27.566 -31.816 1.00 11.21 H new ATOM 0 HB2 HIS A 6 12.159 -29.185 -32.393 1.00 13.32 H new ATOM 0 HB3 HIS A 6 12.604 -27.668 -33.150 1.00 13.32 H new ATOM 0 HD2 HIS A 6 14.753 -27.866 -35.041 1.00 2.41 H new ATOM 0 HE1 HIS A 6 14.615 -32.098 -35.255 1.00 15.55 H new ATOM 0 HE2 HIS A 6 15.541 -29.989 -36.332 1.00 40.03 H new ATOM 102 N HIS A 7 12.708 -26.250 -30.712 1.00 35.24 N ATOM 103 CA HIS A 7 11.853 -25.467 -29.825 1.00 21.22 C ATOM 104 C HIS A 7 10.420 -25.469 -30.350 1.00 62.14 C ATOM 105 O HIS A 7 10.104 -24.752 -31.303 1.00 65.32 O ATOM 106 CB HIS A 7 12.360 -24.025 -29.721 1.00 40.00 C ATOM 107 CG HIS A 7 13.775 -23.907 -29.250 1.00 5.42 C ATOM 108 ND1 HIS A 7 14.826 -23.658 -30.101 1.00 32.01 N ATOM 109 CD2 HIS A 7 14.312 -23.995 -28.010 1.00 63.42 C ATOM 110 CE1 HIS A 7 15.946 -23.598 -29.409 1.00 15.31 C ATOM 111 NE2 HIS A 7 15.664 -23.796 -28.136 1.00 2.11 N ATOM 0 H HIS A 7 13.046 -25.739 -31.528 1.00 35.24 H new ATOM 0 HA HIS A 7 11.878 -25.920 -28.834 1.00 21.22 H new ATOM 0 HB2 HIS A 7 12.273 -23.549 -30.698 1.00 40.00 H new ATOM 0 HB3 HIS A 7 11.714 -23.473 -29.039 1.00 40.00 H new ATOM 0 HD2 HIS A 7 13.776 -24.186 -27.092 1.00 63.42 H new ATOM 0 HE1 HIS A 7 16.930 -23.417 -29.816 1.00 15.31 H new ATOM 0 HE2 HIS A 7 16.339 -23.800 -27.371 1.00 2.11 H new ATOM 120 N HIS A 8 9.564 -26.290 -29.747 1.00 54.52 N ATOM 121 CA HIS A 8 8.159 -26.355 -30.149 1.00 71.42 C ATOM 122 C HIS A 8 7.421 -25.115 -29.655 1.00 60.23 C ATOM 123 O HIS A 8 7.677 -24.626 -28.552 1.00 64.12 O ATOM 124 CB HIS A 8 7.482 -27.627 -29.615 1.00 2.44 C ATOM 125 CG HIS A 8 8.019 -28.897 -30.209 1.00 43.31 C ATOM 126 ND1 HIS A 8 8.170 -29.086 -31.565 1.00 41.21 N ATOM 127 CD2 HIS A 8 8.440 -30.045 -29.624 1.00 73.24 C ATOM 128 CE1 HIS A 8 8.654 -30.292 -31.789 1.00 22.34 C ATOM 129 NE2 HIS A 8 8.827 -30.898 -30.628 1.00 54.34 N ATOM 0 H HIS A 8 9.815 -26.917 -28.982 1.00 54.52 H new ATOM 0 HA HIS A 8 8.118 -26.389 -31.238 1.00 71.42 H new ATOM 0 HB2 HIS A 8 7.603 -27.664 -28.532 1.00 2.44 H new ATOM 0 HB3 HIS A 8 6.412 -27.568 -29.814 1.00 2.44 H new ATOM 0 HD2 HIS A 8 8.466 -30.251 -28.564 1.00 73.24 H new ATOM 0 HE1 HIS A 8 8.872 -30.714 -32.759 1.00 22.34 H new ATOM 0 HE2 HIS A 8 9.188 -31.843 -30.499 1.00 54.34 H new ATOM 138 N MET A 9 6.512 -24.607 -30.478 1.00 34.13 N ATOM 139 CA MET A 9 5.779 -23.386 -30.160 1.00 52.34 C ATOM 140 C MET A 9 4.307 -23.541 -30.521 1.00 10.22 C ATOM 141 O MET A 9 3.890 -24.591 -31.023 1.00 4.13 O ATOM 142 CB MET A 9 6.399 -22.184 -30.895 1.00 35.21 C ATOM 143 CG MET A 9 6.427 -22.327 -32.412 1.00 10.04 C ATOM 144 SD MET A 9 7.217 -20.922 -33.230 1.00 4.34 S ATOM 145 CE MET A 9 8.877 -21.020 -32.558 1.00 21.11 C ATOM 0 H MET A 9 6.263 -25.024 -31.375 1.00 34.13 H new ATOM 0 HA MET A 9 5.849 -23.205 -29.087 1.00 52.34 H new ATOM 0 HB2 MET A 9 5.839 -21.286 -30.636 1.00 35.21 H new ATOM 0 HB3 MET A 9 7.418 -22.039 -30.536 1.00 35.21 H new ATOM 0 HG2 MET A 9 6.957 -23.242 -32.677 1.00 10.04 H new ATOM 0 HG3 MET A 9 5.407 -22.431 -32.782 1.00 10.04 H new ATOM 0 HE1 MET A 9 9.564 -20.473 -33.204 1.00 21.11 H new ATOM 0 HE2 MET A 9 8.892 -20.582 -31.560 1.00 21.11 H new ATOM 0 HE3 MET A 9 9.185 -22.064 -32.501 1.00 21.11 H new ATOM 155 N GLY A 10 3.533 -22.491 -30.279 1.00 72.52 N ATOM 156 CA GLY A 10 2.097 -22.558 -30.463 1.00 63.23 C ATOM 157 C GLY A 10 1.381 -22.756 -29.140 1.00 1.24 C ATOM 158 O GLY A 10 1.691 -23.690 -28.396 1.00 31.32 O ATOM 0 H GLY A 10 3.878 -21.587 -29.956 1.00 72.52 H new ATOM 0 HA2 GLY A 10 1.745 -21.641 -30.936 1.00 63.23 H new ATOM 0 HA3 GLY A 10 1.852 -23.378 -31.138 1.00 63.23 H new ATOM 162 N THR A 11 0.449 -21.865 -28.824 1.00 0.32 N ATOM 163 CA THR A 11 -0.313 -21.962 -27.588 1.00 22.11 C ATOM 164 C THR A 11 -1.404 -23.023 -27.718 1.00 23.13 C ATOM 165 O THR A 11 -2.296 -22.897 -28.559 1.00 3.55 O ATOM 166 CB THR A 11 -0.947 -20.600 -27.217 1.00 61.11 C ATOM 167 OG1 THR A 11 -1.654 -20.064 -28.348 1.00 12.15 O ATOM 168 CG2 THR A 11 0.120 -19.606 -26.760 1.00 23.11 C ATOM 0 H THR A 11 0.203 -21.066 -29.409 1.00 0.32 H new ATOM 0 HA THR A 11 0.374 -22.251 -26.793 1.00 22.11 H new ATOM 0 HB THR A 11 -1.644 -20.762 -26.394 1.00 61.11 H new ATOM 0 HG1 THR A 11 -2.113 -20.790 -28.821 1.00 12.15 H new ATOM 0 HG21 THR A 11 -0.352 -18.657 -26.505 1.00 23.11 H new ATOM 0 HG22 THR A 11 0.635 -20.002 -25.885 1.00 23.11 H new ATOM 0 HG23 THR A 11 0.839 -19.449 -27.564 1.00 23.11 H new ATOM 176 N LEU A 12 -1.314 -24.069 -26.894 1.00 23.05 N ATOM 177 CA LEU A 12 -2.291 -25.157 -26.906 1.00 13.01 C ATOM 178 C LEU A 12 -3.698 -24.593 -26.718 1.00 72.23 C ATOM 179 O LEU A 12 -4.552 -24.711 -27.600 1.00 0.21 O ATOM 180 CB LEU A 12 -1.975 -26.194 -25.808 1.00 64.41 C ATOM 181 CG LEU A 12 -0.712 -27.057 -26.030 1.00 51.22 C ATOM 182 CD1 LEU A 12 0.563 -26.215 -25.982 1.00 51.14 C ATOM 183 CD2 LEU A 12 -0.647 -28.185 -24.999 1.00 60.24 C ATOM 0 H LEU A 12 -0.569 -24.185 -26.207 1.00 23.05 H new ATOM 0 HA LEU A 12 -2.236 -25.662 -27.870 1.00 13.01 H new ATOM 0 HB2 LEU A 12 -1.868 -25.668 -24.860 1.00 64.41 H new ATOM 0 HB3 LEU A 12 -2.832 -26.860 -25.708 1.00 64.41 H new ATOM 0 HG LEU A 12 -0.782 -27.493 -27.026 1.00 51.22 H new ATOM 0 HD11 LEU A 12 1.429 -26.857 -26.142 1.00 51.14 H new ATOM 0 HD12 LEU A 12 0.526 -25.454 -26.762 1.00 51.14 H new ATOM 0 HD13 LEU A 12 0.644 -25.733 -25.008 1.00 51.14 H new ATOM 0 HD21 LEU A 12 0.248 -28.783 -25.170 1.00 60.24 H new ATOM 0 HD22 LEU A 12 -0.613 -27.760 -23.996 1.00 60.24 H new ATOM 0 HD23 LEU A 12 -1.529 -28.817 -25.096 1.00 60.24 H new ATOM 195 N GLU A 13 -3.922 -23.966 -25.571 1.00 22.00 N ATOM 196 CA GLU A 13 -5.183 -23.294 -25.290 1.00 22.14 C ATOM 197 C GLU A 13 -4.995 -21.789 -25.447 1.00 41.33 C ATOM 198 O GLU A 13 -4.174 -21.184 -24.750 1.00 42.24 O ATOM 199 CB GLU A 13 -5.673 -23.632 -23.876 1.00 43.13 C ATOM 200 CG GLU A 13 -6.005 -25.109 -23.676 1.00 63.33 C ATOM 201 CD GLU A 13 -7.095 -25.600 -24.620 1.00 30.35 C ATOM 202 OE1 GLU A 13 -8.290 -25.398 -24.319 1.00 14.15 O ATOM 203 OE2 GLU A 13 -6.764 -26.182 -25.673 1.00 43.21 O ATOM 0 H GLU A 13 -3.240 -23.909 -24.814 1.00 22.00 H new ATOM 0 HA GLU A 13 -5.939 -23.638 -25.996 1.00 22.14 H new ATOM 0 HB2 GLU A 13 -4.908 -23.341 -23.157 1.00 43.13 H new ATOM 0 HB3 GLU A 13 -6.559 -23.037 -23.657 1.00 43.13 H new ATOM 0 HG2 GLU A 13 -5.104 -25.703 -23.828 1.00 63.33 H new ATOM 0 HG3 GLU A 13 -6.323 -25.269 -22.646 1.00 63.33 H new ATOM 210 N ALA A 14 -5.743 -21.198 -26.372 1.00 14.03 N ATOM 211 CA ALA A 14 -5.614 -19.778 -26.692 1.00 33.23 C ATOM 212 C ALA A 14 -6.155 -18.901 -25.564 1.00 11.25 C ATOM 213 O ALA A 14 -6.581 -19.399 -24.518 1.00 22.03 O ATOM 214 CB ALA A 14 -6.333 -19.469 -28.002 1.00 1.45 C ATOM 0 H ALA A 14 -6.453 -21.685 -26.919 1.00 14.03 H new ATOM 0 HA ALA A 14 -4.554 -19.551 -26.807 1.00 33.23 H new ATOM 0 HB1 ALA A 14 -6.231 -18.408 -28.232 1.00 1.45 H new ATOM 0 HB2 ALA A 14 -5.893 -20.058 -28.806 1.00 1.45 H new ATOM 0 HB3 ALA A 14 -7.389 -19.719 -27.905 1.00 1.45 H new ATOM 220 N GLN A 15 -6.130 -17.591 -25.790 1.00 71.12 N ATOM 221 CA GLN A 15 -6.597 -16.621 -24.804 1.00 54.40 C ATOM 222 C GLN A 15 -8.096 -16.786 -24.547 1.00 43.42 C ATOM 223 O GLN A 15 -8.851 -17.171 -25.443 1.00 31.11 O ATOM 224 CB GLN A 15 -6.295 -15.195 -25.281 1.00 11.24 C ATOM 225 CG GLN A 15 -4.812 -14.944 -25.540 1.00 43.33 C ATOM 226 CD GLN A 15 -4.531 -13.547 -26.062 1.00 41.31 C ATOM 227 OE1 GLN A 15 -5.365 -12.939 -26.735 1.00 20.25 O ATOM 228 NE2 GLN A 15 -3.351 -13.030 -25.762 1.00 24.31 N ATOM 0 H GLN A 15 -5.788 -17.174 -26.656 1.00 71.12 H new ATOM 0 HA GLN A 15 -6.068 -16.801 -23.868 1.00 54.40 H new ATOM 0 HB2 GLN A 15 -6.854 -15.000 -26.196 1.00 11.24 H new ATOM 0 HB3 GLN A 15 -6.651 -14.487 -24.533 1.00 11.24 H new ATOM 0 HG2 GLN A 15 -4.256 -15.100 -24.616 1.00 43.33 H new ATOM 0 HG3 GLN A 15 -4.445 -15.676 -26.260 1.00 43.33 H new ATOM 0 HE21 GLN A 15 -2.687 -13.565 -25.202 1.00 24.31 H new ATOM 0 HE22 GLN A 15 -3.105 -12.096 -26.091 1.00 24.31 H new ATOM 237 N THR A 16 -8.517 -16.496 -23.320 1.00 0.12 N ATOM 238 CA THR A 16 -9.920 -16.612 -22.926 1.00 75.23 C ATOM 239 C THR A 16 -10.713 -15.347 -23.289 1.00 40.03 C ATOM 240 O THR A 16 -11.850 -15.156 -22.846 1.00 21.31 O ATOM 241 CB THR A 16 -10.030 -16.898 -21.408 1.00 75.20 C ATOM 242 OG1 THR A 16 -9.177 -16.002 -20.677 1.00 44.10 O ATOM 243 CG2 THR A 16 -9.640 -18.338 -21.088 1.00 2.15 C ATOM 0 H THR A 16 -7.901 -16.176 -22.573 1.00 0.12 H new ATOM 0 HA THR A 16 -10.353 -17.447 -23.477 1.00 75.23 H new ATOM 0 HB THR A 16 -11.068 -16.745 -21.113 1.00 75.20 H new ATOM 0 HG1 THR A 16 -9.253 -16.188 -19.718 1.00 44.10 H new ATOM 0 HG21 THR A 16 -9.727 -18.509 -20.015 1.00 2.15 H new ATOM 0 HG22 THR A 16 -10.303 -19.021 -21.619 1.00 2.15 H new ATOM 0 HG23 THR A 16 -8.611 -18.514 -21.401 1.00 2.15 H new ATOM 251 N GLN A 17 -10.109 -14.499 -24.118 1.00 23.22 N ATOM 252 CA GLN A 17 -10.747 -13.276 -24.587 1.00 3.02 C ATOM 253 C GLN A 17 -10.313 -12.978 -26.020 1.00 51.13 C ATOM 254 O GLN A 17 -9.148 -13.175 -26.378 1.00 53.23 O ATOM 255 CB GLN A 17 -10.405 -12.094 -23.664 1.00 70.42 C ATOM 256 CG GLN A 17 -10.973 -10.755 -24.136 1.00 72.33 C ATOM 257 CD GLN A 17 -12.489 -10.768 -24.302 1.00 71.23 C ATOM 258 OE1 GLN A 17 -13.203 -11.479 -23.593 1.00 71.31 O ATOM 259 NE2 GLN A 17 -12.987 -9.987 -25.247 1.00 44.13 N ATOM 0 H GLN A 17 -9.167 -14.641 -24.481 1.00 23.22 H new ATOM 0 HA GLN A 17 -11.828 -13.418 -24.568 1.00 3.02 H new ATOM 0 HB2 GLN A 17 -10.783 -12.306 -22.664 1.00 70.42 H new ATOM 0 HB3 GLN A 17 -9.321 -12.010 -23.584 1.00 70.42 H new ATOM 0 HG2 GLN A 17 -10.699 -9.980 -23.420 1.00 72.33 H new ATOM 0 HG3 GLN A 17 -10.513 -10.488 -25.087 1.00 72.33 H new ATOM 0 HE21 GLN A 17 -12.364 -9.412 -25.814 1.00 44.13 H new ATOM 0 HE22 GLN A 17 -13.994 -9.960 -25.408 1.00 44.13 H new ATOM 268 N GLY A 18 -11.261 -12.521 -26.832 1.00 10.21 N ATOM 269 CA GLY A 18 -10.980 -12.176 -28.213 1.00 61.13 C ATOM 270 C GLY A 18 -12.075 -11.306 -28.806 1.00 70.32 C ATOM 271 O GLY A 18 -12.640 -10.469 -28.105 1.00 74.25 O ATOM 0 H GLY A 18 -12.232 -12.382 -26.552 1.00 10.21 H new ATOM 0 HA2 GLY A 18 -10.026 -11.651 -28.271 1.00 61.13 H new ATOM 0 HA3 GLY A 18 -10.879 -13.087 -28.803 1.00 61.13 H new ATOM 275 N PRO A 19 -12.417 -11.494 -30.095 1.00 71.50 N ATOM 276 CA PRO A 19 -13.451 -10.705 -30.775 1.00 35.41 C ATOM 277 C PRO A 19 -14.869 -11.187 -30.435 1.00 54.13 C ATOM 278 O PRO A 19 -15.774 -11.133 -31.272 1.00 73.40 O ATOM 279 CB PRO A 19 -13.144 -10.922 -32.278 1.00 23.33 C ATOM 280 CG PRO A 19 -11.910 -11.778 -32.332 1.00 14.54 C ATOM 281 CD PRO A 19 -11.825 -12.480 -31.005 1.00 31.43 C ATOM 0 HA PRO A 19 -13.429 -9.658 -30.474 1.00 35.41 H new ATOM 0 HB2 PRO A 19 -13.979 -11.410 -32.780 1.00 23.33 H new ATOM 0 HB3 PRO A 19 -12.981 -9.970 -32.784 1.00 23.33 H new ATOM 0 HG2 PRO A 19 -11.971 -12.497 -33.149 1.00 14.54 H new ATOM 0 HG3 PRO A 19 -11.022 -11.170 -32.508 1.00 14.54 H new ATOM 0 HD2 PRO A 19 -12.379 -13.419 -31.005 1.00 31.43 H new ATOM 0 HD3 PRO A 19 -10.796 -12.717 -30.735 1.00 31.43 H new ATOM 289 N GLY A 20 -15.064 -11.636 -29.198 1.00 31.23 N ATOM 290 CA GLY A 20 -16.349 -12.171 -28.783 1.00 1.24 C ATOM 291 C GLY A 20 -17.347 -11.084 -28.427 1.00 25.15 C ATOM 292 O GLY A 20 -17.677 -10.894 -27.254 1.00 53.44 O ATOM 0 H GLY A 20 -14.349 -11.638 -28.471 1.00 31.23 H new ATOM 0 HA2 GLY A 20 -16.758 -12.786 -29.584 1.00 1.24 H new ATOM 0 HA3 GLY A 20 -16.206 -12.824 -27.922 1.00 1.24 H new ATOM 296 N SER A 21 -17.822 -10.367 -29.437 1.00 21.21 N ATOM 297 CA SER A 21 -18.818 -9.318 -29.248 1.00 53.15 C ATOM 298 C SER A 21 -19.638 -9.166 -30.527 1.00 14.20 C ATOM 299 O SER A 21 -19.080 -9.164 -31.625 1.00 73.52 O ATOM 300 CB SER A 21 -18.133 -7.989 -28.880 1.00 54.50 C ATOM 301 OG SER A 21 -19.086 -6.984 -28.563 1.00 2.55 O ATOM 0 H SER A 21 -17.530 -10.494 -30.406 1.00 21.21 H new ATOM 0 HA SER A 21 -19.483 -9.592 -28.429 1.00 53.15 H new ATOM 0 HB2 SER A 21 -17.469 -8.144 -28.030 1.00 54.50 H new ATOM 0 HB3 SER A 21 -17.513 -7.655 -29.712 1.00 54.50 H new ATOM 0 HG SER A 21 -18.621 -6.153 -28.332 1.00 2.55 H new ATOM 307 N MET A 22 -20.959 -9.059 -30.386 1.00 23.10 N ATOM 308 CA MET A 22 -21.853 -8.970 -31.544 1.00 1.00 C ATOM 309 C MET A 22 -21.904 -7.543 -32.094 1.00 72.15 C ATOM 310 O MET A 22 -22.281 -7.327 -33.243 1.00 54.32 O ATOM 311 CB MET A 22 -23.270 -9.440 -31.169 1.00 40.45 C ATOM 312 CG MET A 22 -24.004 -8.504 -30.214 1.00 23.11 C ATOM 313 SD MET A 22 -25.643 -9.110 -29.767 1.00 11.22 S ATOM 314 CE MET A 22 -26.253 -7.745 -28.777 1.00 2.32 C ATOM 0 H MET A 22 -21.435 -9.032 -29.484 1.00 23.10 H new ATOM 0 HA MET A 22 -21.457 -9.623 -32.321 1.00 1.00 H new ATOM 0 HB2 MET A 22 -23.859 -9.547 -32.080 1.00 40.45 H new ATOM 0 HB3 MET A 22 -23.205 -10.428 -30.714 1.00 40.45 H new ATOM 0 HG2 MET A 22 -23.410 -8.376 -29.309 1.00 23.11 H new ATOM 0 HG3 MET A 22 -24.098 -7.521 -30.676 1.00 23.11 H new ATOM 0 HE1 MET A 22 -27.260 -7.971 -28.427 1.00 2.32 H new ATOM 0 HE2 MET A 22 -25.596 -7.595 -27.920 1.00 2.32 H new ATOM 0 HE3 MET A 22 -26.274 -6.838 -29.381 1.00 2.32 H new ATOM 324 N SER A 23 -21.519 -6.576 -31.272 1.00 10.14 N ATOM 325 CA SER A 23 -21.571 -5.172 -31.663 1.00 32.11 C ATOM 326 C SER A 23 -20.383 -4.817 -32.557 1.00 62.52 C ATOM 327 O SER A 23 -19.414 -5.576 -32.657 1.00 32.10 O ATOM 328 CB SER A 23 -21.588 -4.275 -30.419 1.00 71.33 C ATOM 329 OG SER A 23 -21.799 -2.912 -30.763 1.00 5.30 O ATOM 0 H SER A 23 -21.167 -6.738 -30.329 1.00 10.14 H new ATOM 0 HA SER A 23 -22.488 -5.005 -32.228 1.00 32.11 H new ATOM 0 HB2 SER A 23 -22.374 -4.606 -29.741 1.00 71.33 H new ATOM 0 HB3 SER A 23 -20.643 -4.374 -29.884 1.00 71.33 H new ATOM 0 HG SER A 23 -21.806 -2.367 -29.949 1.00 5.30 H new ATOM 335 N ALA A 24 -20.470 -3.654 -33.196 1.00 60.44 N ATOM 336 CA ALA A 24 -19.431 -3.177 -34.100 1.00 54.02 C ATOM 337 C ALA A 24 -18.100 -2.996 -33.369 1.00 62.11 C ATOM 338 O ALA A 24 -17.957 -2.104 -32.528 1.00 62.02 O ATOM 339 CB ALA A 24 -19.864 -1.865 -34.752 1.00 34.21 C ATOM 0 H ALA A 24 -21.261 -3.018 -33.101 1.00 60.44 H new ATOM 0 HA ALA A 24 -19.285 -3.928 -34.876 1.00 54.02 H new ATOM 0 HB1 ALA A 24 -19.081 -1.517 -35.425 1.00 34.21 H new ATOM 0 HB2 ALA A 24 -20.783 -2.025 -35.316 1.00 34.21 H new ATOM 0 HB3 ALA A 24 -20.038 -1.115 -33.980 1.00 34.21 H new ATOM 345 N GLN A 25 -17.143 -3.863 -33.677 1.00 52.11 N ATOM 346 CA GLN A 25 -15.792 -3.751 -33.138 1.00 33.31 C ATOM 347 C GLN A 25 -14.945 -2.941 -34.111 1.00 11.54 C ATOM 348 O GLN A 25 -15.004 -3.174 -35.319 1.00 33.33 O ATOM 349 CB GLN A 25 -15.188 -5.151 -32.949 1.00 24.32 C ATOM 350 CG GLN A 25 -16.082 -6.104 -32.164 1.00 62.34 C ATOM 351 CD GLN A 25 -15.560 -7.533 -32.155 1.00 50.24 C ATOM 352 OE1 GLN A 25 -14.354 -7.769 -32.203 1.00 54.31 O ATOM 353 NE2 GLN A 25 -16.468 -8.499 -32.106 1.00 0.52 N ATOM 0 H GLN A 25 -17.279 -4.657 -34.302 1.00 52.11 H new ATOM 0 HA GLN A 25 -15.817 -3.252 -32.169 1.00 33.31 H new ATOM 0 HB2 GLN A 25 -14.983 -5.583 -33.928 1.00 24.32 H new ATOM 0 HB3 GLN A 25 -14.231 -5.058 -32.435 1.00 24.32 H new ATOM 0 HG2 GLN A 25 -16.171 -5.748 -31.137 1.00 62.34 H new ATOM 0 HG3 GLN A 25 -17.084 -6.091 -32.593 1.00 62.34 H new ATOM 0 HE21 GLN A 25 -17.460 -8.265 -32.067 1.00 0.52 H new ATOM 0 HE22 GLN A 25 -16.174 -9.476 -32.107 1.00 0.52 H new ATOM 362 N LEU A 26 -14.163 -1.997 -33.601 1.00 30.13 N ATOM 363 CA LEU A 26 -13.398 -1.111 -34.470 1.00 12.14 C ATOM 364 C LEU A 26 -12.051 -0.724 -33.866 1.00 51.43 C ATOM 365 O LEU A 26 -11.979 0.112 -32.963 1.00 61.15 O ATOM 366 CB LEU A 26 -14.216 0.151 -34.792 1.00 71.53 C ATOM 367 CG LEU A 26 -13.507 1.192 -35.682 1.00 4.02 C ATOM 368 CD1 LEU A 26 -13.083 0.577 -37.011 1.00 1.33 C ATOM 369 CD2 LEU A 26 -14.400 2.409 -35.912 1.00 14.44 C ATOM 0 H LEU A 26 -14.042 -1.826 -32.603 1.00 30.13 H new ATOM 0 HA LEU A 26 -13.194 -1.659 -35.390 1.00 12.14 H new ATOM 0 HB2 LEU A 26 -15.141 -0.152 -35.283 1.00 71.53 H new ATOM 0 HB3 LEU A 26 -14.496 0.631 -33.854 1.00 71.53 H new ATOM 0 HG LEU A 26 -12.609 1.522 -35.160 1.00 4.02 H new ATOM 0 HD11 LEU A 26 -12.586 1.332 -37.619 1.00 1.33 H new ATOM 0 HD12 LEU A 26 -12.397 -0.250 -36.827 1.00 1.33 H new ATOM 0 HD13 LEU A 26 -13.963 0.208 -37.538 1.00 1.33 H new ATOM 0 HD21 LEU A 26 -13.878 3.129 -36.542 1.00 14.44 H new ATOM 0 HD22 LEU A 26 -15.321 2.097 -36.404 1.00 14.44 H new ATOM 0 HD23 LEU A 26 -14.639 2.871 -34.954 1.00 14.44 H new ATOM 381 N GLU A 27 -10.990 -1.352 -34.355 1.00 2.20 N ATOM 382 CA GLU A 27 -9.635 -0.883 -34.110 1.00 14.02 C ATOM 383 C GLU A 27 -9.039 -0.378 -35.418 1.00 65.33 C ATOM 384 O GLU A 27 -9.151 -1.037 -36.456 1.00 60.33 O ATOM 385 CB GLU A 27 -8.742 -1.985 -33.518 1.00 53.11 C ATOM 386 CG GLU A 27 -9.044 -2.307 -32.061 1.00 1.14 C ATOM 387 CD GLU A 27 -7.979 -3.194 -31.430 1.00 4.22 C ATOM 388 OE1 GLU A 27 -6.879 -2.681 -31.116 1.00 43.34 O ATOM 389 OE2 GLU A 27 -8.231 -4.400 -31.245 1.00 35.30 O ATOM 0 H GLU A 27 -11.044 -2.194 -34.928 1.00 2.20 H new ATOM 0 HA GLU A 27 -9.681 -0.076 -33.379 1.00 14.02 H new ATOM 0 HB2 GLU A 27 -8.858 -2.892 -34.112 1.00 53.11 H new ATOM 0 HB3 GLU A 27 -7.699 -1.679 -33.604 1.00 53.11 H new ATOM 0 HG2 GLU A 27 -9.122 -1.379 -31.495 1.00 1.14 H new ATOM 0 HG3 GLU A 27 -10.012 -2.803 -31.994 1.00 1.14 H new ATOM 396 N LYS A 28 -8.436 0.804 -35.368 1.00 20.23 N ATOM 397 CA LYS A 28 -7.750 1.376 -36.520 1.00 1.42 C ATOM 398 C LYS A 28 -6.354 1.821 -36.082 1.00 24.22 C ATOM 399 O LYS A 28 -6.186 2.840 -35.409 1.00 43.22 O ATOM 400 CB LYS A 28 -8.561 2.537 -37.153 1.00 13.42 C ATOM 401 CG LYS A 28 -8.750 3.782 -36.279 1.00 53.12 C ATOM 402 CD LYS A 28 -9.602 3.518 -35.037 1.00 50.34 C ATOM 403 CE LYS A 28 -9.744 4.770 -34.176 1.00 71.00 C ATOM 404 NZ LYS A 28 -8.425 5.292 -33.722 1.00 31.34 N ATOM 0 H LYS A 28 -8.409 1.390 -34.533 1.00 20.23 H new ATOM 0 HA LYS A 28 -7.656 0.621 -37.300 1.00 1.42 H new ATOM 0 HB2 LYS A 28 -8.066 2.838 -38.076 1.00 13.42 H new ATOM 0 HB3 LYS A 28 -9.545 2.158 -37.428 1.00 13.42 H new ATOM 0 HG2 LYS A 28 -7.773 4.154 -35.970 1.00 53.12 H new ATOM 0 HG3 LYS A 28 -9.217 4.568 -36.872 1.00 53.12 H new ATOM 0 HD2 LYS A 28 -10.590 3.170 -35.340 1.00 50.34 H new ATOM 0 HD3 LYS A 28 -9.150 2.720 -34.448 1.00 50.34 H new ATOM 0 HE2 LYS A 28 -10.263 5.542 -34.744 1.00 71.00 H new ATOM 0 HE3 LYS A 28 -10.362 4.543 -33.307 1.00 71.00 H new ATOM 0 HZ1 LYS A 28 -8.570 5.985 -32.960 1.00 31.34 H new ATOM 0 HZ2 LYS A 28 -7.843 4.506 -33.369 1.00 31.34 H new ATOM 0 HZ3 LYS A 28 -7.940 5.750 -34.520 1.00 31.34 H new ATOM 418 N LYS A 29 -5.359 1.005 -36.407 1.00 10.31 N ATOM 419 CA LYS A 29 -3.996 1.226 -35.934 1.00 4.51 C ATOM 420 C LYS A 29 -3.028 1.336 -37.108 1.00 32.22 C ATOM 421 O LYS A 29 -2.825 0.374 -37.852 1.00 50.14 O ATOM 422 CB LYS A 29 -3.596 0.091 -34.975 1.00 34.44 C ATOM 423 CG LYS A 29 -4.465 0.052 -33.718 1.00 63.44 C ATOM 424 CD LYS A 29 -4.122 -1.112 -32.789 1.00 73.32 C ATOM 425 CE LYS A 29 -4.482 -2.465 -33.395 1.00 34.34 C ATOM 426 NZ LYS A 29 -4.478 -3.544 -32.370 1.00 5.41 N ATOM 0 H LYS A 29 -5.470 0.181 -36.998 1.00 10.31 H new ATOM 0 HA LYS A 29 -3.951 2.170 -35.391 1.00 4.51 H new ATOM 0 HB2 LYS A 29 -3.673 -0.864 -35.495 1.00 34.44 H new ATOM 0 HB3 LYS A 29 -2.552 0.214 -34.687 1.00 34.44 H new ATOM 0 HG2 LYS A 29 -4.349 0.990 -33.174 1.00 63.44 H new ATOM 0 HG3 LYS A 29 -5.513 -0.020 -34.010 1.00 63.44 H new ATOM 0 HD2 LYS A 29 -3.056 -1.090 -32.562 1.00 73.32 H new ATOM 0 HD3 LYS A 29 -4.651 -0.988 -31.844 1.00 73.32 H new ATOM 0 HE2 LYS A 29 -5.467 -2.406 -33.858 1.00 34.34 H new ATOM 0 HE3 LYS A 29 -3.772 -2.711 -34.185 1.00 34.34 H new ATOM 0 HZ1 LYS A 29 -4.490 -4.471 -32.842 1.00 5.41 H new ATOM 0 HZ2 LYS A 29 -3.622 -3.464 -31.785 1.00 5.41 H new ATOM 0 HZ3 LYS A 29 -5.319 -3.452 -31.766 1.00 5.41 H new ATOM 440 N VAL A 30 -2.456 2.525 -37.284 1.00 1.11 N ATOM 441 CA VAL A 30 -1.540 2.787 -38.386 1.00 62.04 C ATOM 442 C VAL A 30 -0.277 1.936 -38.258 1.00 61.23 C ATOM 443 O VAL A 30 0.501 2.084 -37.315 1.00 52.32 O ATOM 444 CB VAL A 30 -1.174 4.296 -38.472 1.00 12.12 C ATOM 445 CG1 VAL A 30 -0.599 4.806 -37.144 1.00 33.10 C ATOM 446 CG2 VAL A 30 -0.215 4.555 -39.635 1.00 70.43 C ATOM 0 H VAL A 30 -2.614 3.326 -36.672 1.00 1.11 H new ATOM 0 HA VAL A 30 -2.049 2.512 -39.310 1.00 62.04 H new ATOM 0 HB VAL A 30 -2.089 4.856 -38.664 1.00 12.12 H new ATOM 0 HG11 VAL A 30 -0.353 5.864 -37.236 1.00 33.10 H new ATOM 0 HG12 VAL A 30 -1.337 4.673 -36.353 1.00 33.10 H new ATOM 0 HG13 VAL A 30 0.302 4.244 -36.898 1.00 33.10 H new ATOM 0 HG21 VAL A 30 0.028 5.617 -39.677 1.00 70.43 H new ATOM 0 HG22 VAL A 30 0.699 3.979 -39.488 1.00 70.43 H new ATOM 0 HG23 VAL A 30 -0.687 4.254 -40.570 1.00 70.43 H new ATOM 456 N LEU A 31 -0.093 1.022 -39.200 1.00 3.31 N ATOM 457 CA LEU A 31 1.066 0.146 -39.198 1.00 51.44 C ATOM 458 C LEU A 31 2.242 0.858 -39.860 1.00 63.53 C ATOM 459 O LEU A 31 3.345 0.926 -39.304 1.00 71.22 O ATOM 460 CB LEU A 31 0.743 -1.166 -39.931 1.00 73.13 C ATOM 461 CG LEU A 31 1.845 -2.235 -39.875 1.00 33.10 C ATOM 462 CD1 LEU A 31 2.144 -2.637 -38.428 1.00 41.32 C ATOM 463 CD2 LEU A 31 1.452 -3.449 -40.711 1.00 61.33 C ATOM 0 H LEU A 31 -0.735 0.869 -39.978 1.00 3.31 H new ATOM 0 HA LEU A 31 1.333 -0.098 -38.170 1.00 51.44 H new ATOM 0 HB2 LEU A 31 -0.169 -1.585 -39.507 1.00 73.13 H new ATOM 0 HB3 LEU A 31 0.533 -0.938 -40.976 1.00 73.13 H new ATOM 0 HG LEU A 31 2.757 -1.811 -40.296 1.00 33.10 H new ATOM 0 HD11 LEU A 31 2.927 -3.395 -38.415 1.00 41.32 H new ATOM 0 HD12 LEU A 31 2.476 -1.762 -37.869 1.00 41.32 H new ATOM 0 HD13 LEU A 31 1.242 -3.040 -37.969 1.00 41.32 H new ATOM 0 HD21 LEU A 31 2.243 -4.197 -40.661 1.00 61.33 H new ATOM 0 HD22 LEU A 31 0.526 -3.874 -40.323 1.00 61.33 H new ATOM 0 HD23 LEU A 31 1.305 -3.145 -41.747 1.00 61.33 H new ATOM 475 N THR A 32 1.982 1.410 -41.040 1.00 73.42 N ATOM 476 CA THR A 32 2.974 2.173 -41.789 1.00 63.14 C ATOM 477 C THR A 32 2.553 3.645 -41.839 1.00 74.03 C ATOM 478 O THR A 32 1.526 3.969 -42.435 1.00 24.43 O ATOM 479 CB THR A 32 3.117 1.623 -43.225 1.00 71.24 C ATOM 480 OG1 THR A 32 3.268 0.197 -43.180 1.00 42.12 O ATOM 481 CG2 THR A 32 4.318 2.241 -43.940 1.00 61.24 C ATOM 0 H THR A 32 1.077 1.341 -41.505 1.00 73.42 H new ATOM 0 HA THR A 32 3.937 2.082 -41.287 1.00 63.14 H new ATOM 0 HB THR A 32 2.217 1.886 -43.781 1.00 71.24 H new ATOM 0 HG1 THR A 32 3.357 -0.151 -44.092 1.00 42.12 H new ATOM 0 HG21 THR A 32 4.391 1.833 -44.948 1.00 61.24 H new ATOM 0 HG22 THR A 32 4.192 3.322 -43.994 1.00 61.24 H new ATOM 0 HG23 THR A 32 5.229 2.009 -43.388 1.00 61.24 H new ATOM 489 N PRO A 33 3.320 4.545 -41.190 1.00 53.10 N ATOM 490 CA PRO A 33 2.973 5.974 -41.111 1.00 31.44 C ATOM 491 C PRO A 33 3.064 6.673 -42.469 1.00 3.51 C ATOM 492 O PRO A 33 3.973 6.397 -43.259 1.00 22.31 O ATOM 493 CB PRO A 33 4.013 6.540 -40.132 1.00 1.05 C ATOM 494 CG PRO A 33 5.175 5.613 -40.238 1.00 71.12 C ATOM 495 CD PRO A 33 4.590 4.248 -40.497 1.00 42.35 C ATOM 0 HA PRO A 33 1.943 6.128 -40.789 1.00 31.44 H new ATOM 0 HB2 PRO A 33 4.294 7.559 -40.398 1.00 1.05 H new ATOM 0 HB3 PRO A 33 3.623 6.572 -39.115 1.00 1.05 H new ATOM 0 HG2 PRO A 33 5.841 5.913 -41.047 1.00 71.12 H new ATOM 0 HG3 PRO A 33 5.764 5.618 -39.321 1.00 71.12 H new ATOM 0 HD2 PRO A 33 5.251 3.638 -41.113 1.00 42.35 H new ATOM 0 HD3 PRO A 33 4.423 3.700 -39.570 1.00 42.35 H new ATOM 503 N GLY A 34 2.118 7.572 -42.734 1.00 1.22 N ATOM 504 CA GLY A 34 2.105 8.311 -43.986 1.00 71.12 C ATOM 505 C GLY A 34 2.706 9.695 -43.853 1.00 51.22 C ATOM 506 O GLY A 34 3.324 10.020 -42.833 1.00 33.52 O ATOM 0 H GLY A 34 1.355 7.803 -42.098 1.00 1.22 H new ATOM 0 HA2 GLY A 34 2.657 7.750 -44.740 1.00 71.12 H new ATOM 0 HA3 GLY A 34 1.078 8.398 -44.342 1.00 71.12 H new ATOM 510 N ASP A 35 2.535 10.512 -44.890 1.00 1.32 N ATOM 511 CA ASP A 35 3.066 11.875 -44.901 1.00 65.45 C ATOM 512 C ASP A 35 2.308 12.752 -43.901 1.00 14.34 C ATOM 513 O ASP A 35 2.913 13.504 -43.138 1.00 32.43 O ATOM 514 CB ASP A 35 2.965 12.480 -46.308 1.00 64.24 C ATOM 515 CG ASP A 35 1.537 12.828 -46.683 1.00 72.41 C ATOM 516 OD1 ASP A 35 0.694 11.918 -46.717 1.00 4.21 O ATOM 517 OD2 ASP A 35 1.243 14.013 -46.907 1.00 51.11 O ATOM 0 H ASP A 35 2.031 10.253 -45.738 1.00 1.32 H new ATOM 0 HA ASP A 35 4.116 11.835 -44.610 1.00 65.45 H new ATOM 0 HB2 ASP A 35 3.581 13.378 -46.360 1.00 64.24 H new ATOM 0 HB3 ASP A 35 3.368 11.774 -47.035 1.00 64.24 H new ATOM 522 N GLY A 36 0.979 12.654 -43.925 1.00 33.03 N ATOM 523 CA GLY A 36 0.146 13.376 -42.976 1.00 42.44 C ATOM 524 C GLY A 36 -0.374 14.707 -43.499 1.00 51.13 C ATOM 525 O GLY A 36 -1.379 15.216 -42.995 1.00 23.41 O ATOM 0 H GLY A 36 0.461 12.082 -44.592 1.00 33.03 H new ATOM 0 HA2 GLY A 36 -0.702 12.749 -42.701 1.00 42.44 H new ATOM 0 HA3 GLY A 36 0.719 13.553 -42.066 1.00 42.44 H new ATOM 529 N VAL A 37 0.279 15.271 -44.519 1.00 62.44 N ATOM 530 CA VAL A 37 -0.044 16.630 -44.974 1.00 70.24 C ATOM 531 C VAL A 37 -0.873 16.639 -46.264 1.00 51.32 C ATOM 532 O VAL A 37 -1.229 17.708 -46.769 1.00 73.24 O ATOM 533 CB VAL A 37 1.234 17.489 -45.169 1.00 11.24 C ATOM 534 CG1 VAL A 37 1.991 17.620 -43.852 1.00 11.54 C ATOM 535 CG2 VAL A 37 2.134 16.914 -46.259 1.00 52.31 C ATOM 0 H VAL A 37 1.027 14.815 -45.042 1.00 62.44 H new ATOM 0 HA VAL A 37 -0.650 17.071 -44.182 1.00 70.24 H new ATOM 0 HB VAL A 37 0.925 18.483 -45.493 1.00 11.24 H new ATOM 0 HG11 VAL A 37 2.885 18.225 -44.005 1.00 11.54 H new ATOM 0 HG12 VAL A 37 1.351 18.099 -43.111 1.00 11.54 H new ATOM 0 HG13 VAL A 37 2.279 16.630 -43.498 1.00 11.54 H new ATOM 0 HG21 VAL A 37 3.019 17.541 -46.368 1.00 52.31 H new ATOM 0 HG22 VAL A 37 2.437 15.903 -45.985 1.00 52.31 H new ATOM 0 HG23 VAL A 37 1.590 16.887 -47.203 1.00 52.31 H new ATOM 545 N THR A 38 -1.171 15.459 -46.802 1.00 10.01 N ATOM 546 CA THR A 38 -2.056 15.348 -47.961 1.00 12.05 C ATOM 547 C THR A 38 -3.521 15.317 -47.518 1.00 25.34 C ATOM 548 O THR A 38 -3.854 14.737 -46.479 1.00 54.22 O ATOM 549 CB THR A 38 -1.739 14.087 -48.807 1.00 44.23 C ATOM 550 OG1 THR A 38 -1.572 12.947 -47.953 1.00 15.11 O ATOM 551 CG2 THR A 38 -0.484 14.288 -49.652 1.00 33.03 C ATOM 0 H THR A 38 -0.814 14.568 -46.456 1.00 10.01 H new ATOM 0 HA THR A 38 -1.885 16.226 -48.583 1.00 12.05 H new ATOM 0 HB THR A 38 -2.580 13.916 -49.479 1.00 44.23 H new ATOM 0 HG1 THR A 38 -0.617 12.784 -47.808 1.00 15.11 H new ATOM 0 HG21 THR A 38 -0.289 13.387 -50.233 1.00 33.03 H new ATOM 0 HG22 THR A 38 -0.631 15.131 -50.328 1.00 33.03 H new ATOM 0 HG23 THR A 38 0.365 14.490 -49.000 1.00 33.03 H new ATOM 559 N LYS A 39 -4.389 15.966 -48.295 1.00 43.31 N ATOM 560 CA LYS A 39 -5.824 15.992 -48.010 1.00 13.11 C ATOM 561 C LYS A 39 -6.588 15.235 -49.098 1.00 41.21 C ATOM 562 O LYS A 39 -6.513 15.597 -50.273 1.00 63.14 O ATOM 563 CB LYS A 39 -6.356 17.438 -47.923 1.00 22.03 C ATOM 564 CG LYS A 39 -5.767 18.282 -46.788 1.00 14.54 C ATOM 565 CD LYS A 39 -4.354 18.766 -47.099 1.00 41.50 C ATOM 566 CE LYS A 39 -3.845 19.742 -46.043 1.00 4.21 C ATOM 567 NZ LYS A 39 -4.711 20.948 -45.936 1.00 32.51 N ATOM 0 H LYS A 39 -4.121 16.484 -49.132 1.00 43.31 H new ATOM 0 HA LYS A 39 -5.979 15.510 -47.045 1.00 13.11 H new ATOM 0 HB2 LYS A 39 -6.155 17.940 -48.870 1.00 22.03 H new ATOM 0 HB3 LYS A 39 -7.439 17.403 -47.804 1.00 22.03 H new ATOM 0 HG2 LYS A 39 -6.411 19.142 -46.606 1.00 14.54 H new ATOM 0 HG3 LYS A 39 -5.753 17.694 -45.870 1.00 14.54 H new ATOM 0 HD2 LYS A 39 -3.681 17.910 -47.158 1.00 41.50 H new ATOM 0 HD3 LYS A 39 -4.342 19.249 -48.076 1.00 41.50 H new ATOM 0 HE2 LYS A 39 -3.801 19.240 -45.076 1.00 4.21 H new ATOM 0 HE3 LYS A 39 -2.828 20.046 -46.291 1.00 4.21 H new ATOM 0 HZ1 LYS A 39 -4.185 21.713 -45.467 1.00 32.51 H new ATOM 0 HZ2 LYS A 39 -4.996 21.256 -46.888 1.00 32.51 H new ATOM 0 HZ3 LYS A 39 -5.558 20.719 -45.378 1.00 32.51 H new ATOM 581 N PRO A 40 -7.317 14.164 -48.728 1.00 42.33 N ATOM 582 CA PRO A 40 -8.151 13.412 -49.672 1.00 34.02 C ATOM 583 C PRO A 40 -9.364 14.227 -50.124 1.00 15.53 C ATOM 584 O PRO A 40 -9.944 14.980 -49.334 1.00 20.24 O ATOM 585 CB PRO A 40 -8.593 12.167 -48.870 1.00 14.44 C ATOM 586 CG PRO A 40 -7.731 12.154 -47.647 1.00 71.04 C ATOM 587 CD PRO A 40 -7.386 13.592 -47.376 1.00 13.23 C ATOM 0 HA PRO A 40 -7.613 13.159 -50.586 1.00 34.02 H new ATOM 0 HB2 PRO A 40 -9.649 12.225 -48.606 1.00 14.44 H new ATOM 0 HB3 PRO A 40 -8.460 11.256 -49.454 1.00 14.44 H new ATOM 0 HG2 PRO A 40 -8.258 11.712 -46.801 1.00 71.04 H new ATOM 0 HG3 PRO A 40 -6.832 11.559 -47.808 1.00 71.04 H new ATOM 0 HD2 PRO A 40 -8.144 14.083 -46.766 1.00 13.23 H new ATOM 0 HD3 PRO A 40 -6.439 13.689 -46.846 1.00 13.23 H new ATOM 595 N GLN A 41 -9.741 14.077 -51.393 1.00 71.30 N ATOM 596 CA GLN A 41 -10.893 14.785 -51.947 1.00 74.23 C ATOM 597 C GLN A 41 -11.536 13.968 -53.067 1.00 54.51 C ATOM 598 O GLN A 41 -10.841 13.313 -53.853 1.00 73.51 O ATOM 599 CB GLN A 41 -10.485 16.178 -52.453 1.00 32.32 C ATOM 600 CG GLN A 41 -9.373 16.167 -53.496 1.00 20.14 C ATOM 601 CD GLN A 41 -8.976 17.565 -53.934 1.00 75.11 C ATOM 602 OE1 GLN A 41 -9.793 18.488 -53.935 1.00 42.13 O ATOM 603 NE2 GLN A 41 -7.723 17.731 -54.311 1.00 32.25 N ATOM 0 H GLN A 41 -9.263 13.469 -52.058 1.00 71.30 H new ATOM 0 HA GLN A 41 -11.629 14.916 -51.153 1.00 74.23 H new ATOM 0 HB2 GLN A 41 -11.361 16.668 -52.878 1.00 32.32 H new ATOM 0 HB3 GLN A 41 -10.164 16.780 -51.603 1.00 32.32 H new ATOM 0 HG2 GLN A 41 -8.501 15.656 -53.088 1.00 20.14 H new ATOM 0 HG3 GLN A 41 -9.700 15.596 -54.365 1.00 20.14 H new ATOM 0 HE21 GLN A 41 -7.077 16.942 -54.296 1.00 32.25 H new ATOM 0 HE22 GLN A 41 -7.400 18.649 -54.618 1.00 32.25 H new ATOM 612 N ALA A 42 -12.864 14.004 -53.119 1.00 32.14 N ATOM 613 CA ALA A 42 -13.639 13.195 -54.058 1.00 64.43 C ATOM 614 C ALA A 42 -13.552 13.743 -55.482 1.00 53.00 C ATOM 615 O ALA A 42 -13.125 14.884 -55.701 1.00 74.42 O ATOM 616 CB ALA A 42 -15.097 13.114 -53.610 1.00 22.33 C ATOM 0 H ALA A 42 -13.434 14.594 -52.513 1.00 32.14 H new ATOM 0 HA ALA A 42 -13.210 12.193 -54.063 1.00 64.43 H new ATOM 0 HB1 ALA A 42 -15.662 12.509 -54.319 1.00 22.33 H new ATOM 0 HB2 ALA A 42 -15.149 12.659 -52.621 1.00 22.33 H new ATOM 0 HB3 ALA A 42 -15.522 14.117 -53.570 1.00 22.33 H new ATOM 622 N GLY A 43 -13.971 12.921 -56.442 1.00 22.23 N ATOM 623 CA GLY A 43 -13.998 13.328 -57.833 1.00 40.21 C ATOM 624 C GLY A 43 -12.675 13.111 -58.541 1.00 65.14 C ATOM 625 O GLY A 43 -12.421 13.721 -59.581 1.00 43.04 O ATOM 0 H GLY A 43 -14.296 11.969 -56.275 1.00 22.23 H new ATOM 0 HA2 GLY A 43 -14.777 12.771 -58.353 1.00 40.21 H new ATOM 0 HA3 GLY A 43 -14.266 14.383 -57.892 1.00 40.21 H new ATOM 629 N LYS A 44 -11.822 12.248 -57.984 1.00 15.02 N ATOM 630 CA LYS A 44 -10.522 11.949 -58.592 1.00 4.12 C ATOM 631 C LYS A 44 -10.216 10.453 -58.512 1.00 2.42 C ATOM 632 O LYS A 44 -10.819 9.725 -57.718 1.00 21.32 O ATOM 633 CB LYS A 44 -9.386 12.739 -57.912 1.00 74.43 C ATOM 634 CG LYS A 44 -9.598 14.252 -57.872 1.00 13.21 C ATOM 635 CD LYS A 44 -8.298 15.030 -57.625 1.00 25.44 C ATOM 636 CE LYS A 44 -7.479 14.485 -56.450 1.00 74.31 C ATOM 637 NZ LYS A 44 -6.609 13.339 -56.841 1.00 24.40 N ATOM 0 H LYS A 44 -12.007 11.745 -57.116 1.00 15.02 H new ATOM 0 HA LYS A 44 -10.580 12.251 -59.638 1.00 4.12 H new ATOM 0 HB2 LYS A 44 -9.268 12.375 -56.891 1.00 74.43 H new ATOM 0 HB3 LYS A 44 -8.453 12.530 -58.435 1.00 74.43 H new ATOM 0 HG2 LYS A 44 -10.037 14.578 -58.815 1.00 13.21 H new ATOM 0 HG3 LYS A 44 -10.315 14.493 -57.087 1.00 13.21 H new ATOM 0 HD2 LYS A 44 -7.688 15.001 -58.528 1.00 25.44 H new ATOM 0 HD3 LYS A 44 -8.539 16.076 -57.436 1.00 25.44 H new ATOM 0 HE2 LYS A 44 -6.860 15.284 -56.042 1.00 74.31 H new ATOM 0 HE3 LYS A 44 -8.155 14.169 -55.656 1.00 74.31 H new ATOM 0 HZ1 LYS A 44 -6.823 12.519 -56.238 1.00 24.40 H new ATOM 0 HZ2 LYS A 44 -6.786 13.093 -57.836 1.00 24.40 H new ATOM 0 HZ3 LYS A 44 -5.611 13.605 -56.722 1.00 24.40 H new ATOM 651 N LYS A 45 -9.276 10.009 -59.340 1.00 31.54 N ATOM 652 CA LYS A 45 -8.806 8.627 -59.327 1.00 2.24 C ATOM 653 C LYS A 45 -7.773 8.447 -58.218 1.00 43.32 C ATOM 654 O LYS A 45 -6.712 9.076 -58.242 1.00 1.42 O ATOM 655 CB LYS A 45 -8.174 8.269 -60.683 1.00 23.45 C ATOM 656 CG LYS A 45 -7.532 6.880 -60.735 1.00 51.53 C ATOM 657 CD LYS A 45 -8.566 5.754 -60.722 1.00 61.23 C ATOM 658 CE LYS A 45 -9.404 5.734 -61.996 1.00 43.20 C ATOM 659 NZ LYS A 45 -8.564 5.580 -63.216 1.00 55.24 N ATOM 0 H LYS A 45 -8.819 10.595 -60.038 1.00 31.54 H new ATOM 0 HA LYS A 45 -9.654 7.967 -59.146 1.00 2.24 H new ATOM 0 HB2 LYS A 45 -8.941 8.330 -61.455 1.00 23.45 H new ATOM 0 HB3 LYS A 45 -7.417 9.015 -60.926 1.00 23.45 H new ATOM 0 HG2 LYS A 45 -6.923 6.799 -61.635 1.00 51.53 H new ATOM 0 HG3 LYS A 45 -6.861 6.762 -59.884 1.00 51.53 H new ATOM 0 HD2 LYS A 45 -8.058 4.796 -60.607 1.00 61.23 H new ATOM 0 HD3 LYS A 45 -9.221 5.873 -59.859 1.00 61.23 H new ATOM 0 HE2 LYS A 45 -10.122 4.915 -61.945 1.00 43.20 H new ATOM 0 HE3 LYS A 45 -9.979 6.658 -62.066 1.00 43.20 H new ATOM 0 HZ1 LYS A 45 -9.167 5.318 -64.022 1.00 55.24 H new ATOM 0 HZ2 LYS A 45 -8.082 6.479 -63.422 1.00 55.24 H new ATOM 0 HZ3 LYS A 45 -7.855 4.836 -63.058 1.00 55.24 H new ATOM 673 N VAL A 46 -8.088 7.600 -57.246 1.00 62.24 N ATOM 674 CA VAL A 46 -7.172 7.304 -56.152 1.00 12.10 C ATOM 675 C VAL A 46 -6.649 5.878 -56.264 1.00 64.05 C ATOM 676 O VAL A 46 -7.321 4.996 -56.813 1.00 45.11 O ATOM 677 CB VAL A 46 -7.839 7.504 -54.768 1.00 33.35 C ATOM 678 CG1 VAL A 46 -8.211 8.970 -54.562 1.00 13.43 C ATOM 679 CG2 VAL A 46 -9.062 6.601 -54.614 1.00 33.14 C ATOM 0 H VAL A 46 -8.977 7.103 -57.193 1.00 62.24 H new ATOM 0 HA VAL A 46 -6.341 8.005 -56.232 1.00 12.10 H new ATOM 0 HB VAL A 46 -7.121 7.223 -53.998 1.00 33.35 H new ATOM 0 HG11 VAL A 46 -8.678 9.093 -53.585 1.00 13.43 H new ATOM 0 HG12 VAL A 46 -7.312 9.584 -54.614 1.00 13.43 H new ATOM 0 HG13 VAL A 46 -8.909 9.281 -55.340 1.00 13.43 H new ATOM 0 HG21 VAL A 46 -9.511 6.761 -53.634 1.00 33.14 H new ATOM 0 HG22 VAL A 46 -9.790 6.838 -55.390 1.00 33.14 H new ATOM 0 HG23 VAL A 46 -8.759 5.558 -54.708 1.00 33.14 H new ATOM 689 N THR A 47 -5.444 5.669 -55.753 1.00 20.33 N ATOM 690 CA THR A 47 -4.796 4.370 -55.779 1.00 43.45 C ATOM 691 C THR A 47 -4.572 3.865 -54.356 1.00 3.34 C ATOM 692 O THR A 47 -3.722 4.386 -53.624 1.00 53.32 O ATOM 693 CB THR A 47 -3.447 4.455 -56.520 1.00 31.33 C ATOM 694 OG1 THR A 47 -3.655 5.046 -57.809 1.00 10.14 O ATOM 695 CG2 THR A 47 -2.807 3.078 -56.679 1.00 54.21 C ATOM 0 H THR A 47 -4.888 6.399 -55.308 1.00 20.33 H new ATOM 0 HA THR A 47 -5.445 3.672 -56.308 1.00 43.45 H new ATOM 0 HB THR A 47 -2.768 5.070 -55.929 1.00 31.33 H new ATOM 0 HG1 THR A 47 -2.789 5.251 -58.219 1.00 10.14 H new ATOM 0 HG21 THR A 47 -1.858 3.177 -57.206 1.00 54.21 H new ATOM 0 HG22 THR A 47 -2.633 2.642 -55.695 1.00 54.21 H new ATOM 0 HG23 THR A 47 -3.473 2.431 -57.250 1.00 54.21 H new ATOM 703 N VAL A 48 -5.347 2.859 -53.977 1.00 1.43 N ATOM 704 CA VAL A 48 -5.285 2.273 -52.645 1.00 41.03 C ATOM 705 C VAL A 48 -4.830 0.817 -52.722 1.00 2.14 C ATOM 706 O VAL A 48 -4.592 0.283 -53.807 1.00 5.01 O ATOM 707 CB VAL A 48 -6.662 2.335 -51.935 1.00 25.31 C ATOM 708 CG1 VAL A 48 -7.140 3.779 -51.793 1.00 2.44 C ATOM 709 CG2 VAL A 48 -7.691 1.486 -52.682 1.00 31.14 C ATOM 0 H VAL A 48 -6.039 2.424 -54.587 1.00 1.43 H new ATOM 0 HA VAL A 48 -4.565 2.854 -52.068 1.00 41.03 H new ATOM 0 HB VAL A 48 -6.547 1.924 -50.932 1.00 25.31 H new ATOM 0 HG11 VAL A 48 -8.108 3.794 -51.292 1.00 2.44 H new ATOM 0 HG12 VAL A 48 -6.418 4.345 -51.205 1.00 2.44 H new ATOM 0 HG13 VAL A 48 -7.236 4.229 -52.781 1.00 2.44 H new ATOM 0 HG21 VAL A 48 -8.651 1.542 -52.168 1.00 31.14 H new ATOM 0 HG22 VAL A 48 -7.802 1.860 -53.700 1.00 31.14 H new ATOM 0 HG23 VAL A 48 -7.355 0.449 -52.711 1.00 31.14 H new ATOM 719 N HIS A 49 -4.699 0.191 -51.566 1.00 0.12 N ATOM 720 CA HIS A 49 -4.356 -1.218 -51.472 1.00 21.40 C ATOM 721 C HIS A 49 -4.994 -1.803 -50.221 1.00 62.51 C ATOM 722 O HIS A 49 -5.131 -1.113 -49.208 1.00 12.42 O ATOM 723 CB HIS A 49 -2.830 -1.410 -51.437 1.00 65.53 C ATOM 724 CG HIS A 49 -2.403 -2.839 -51.286 1.00 3.22 C ATOM 725 ND1 HIS A 49 -2.189 -3.679 -52.357 1.00 4.14 N ATOM 726 CD2 HIS A 49 -2.173 -3.582 -50.177 1.00 44.34 C ATOM 727 CE1 HIS A 49 -1.852 -4.873 -51.912 1.00 71.41 C ATOM 728 NE2 HIS A 49 -1.836 -4.846 -50.592 1.00 60.41 N ATOM 0 H HIS A 49 -4.828 0.647 -50.663 1.00 0.12 H new ATOM 0 HA HIS A 49 -4.736 -1.737 -52.352 1.00 21.40 H new ATOM 0 HB2 HIS A 49 -2.401 -1.008 -52.355 1.00 65.53 H new ATOM 0 HB3 HIS A 49 -2.419 -0.829 -50.612 1.00 65.53 H new ATOM 0 HD2 HIS A 49 -2.242 -3.242 -49.154 1.00 44.34 H new ATOM 0 HE1 HIS A 49 -1.626 -5.732 -52.526 1.00 71.41 H new ATOM 0 HE2 HIS A 49 -1.611 -5.633 -49.983 1.00 60.41 H new ATOM 737 N TYR A 50 -5.385 -3.067 -50.299 1.00 14.34 N ATOM 738 CA TYR A 50 -5.996 -3.762 -49.171 1.00 11.42 C ATOM 739 C TYR A 50 -5.243 -5.057 -48.897 1.00 70.24 C ATOM 740 O TYR A 50 -4.640 -5.634 -49.804 1.00 63.33 O ATOM 741 CB TYR A 50 -7.467 -4.097 -49.468 1.00 61.52 C ATOM 742 CG TYR A 50 -8.340 -2.896 -49.786 1.00 44.20 C ATOM 743 CD1 TYR A 50 -9.013 -2.211 -48.779 1.00 71.34 C ATOM 744 CD2 TYR A 50 -8.508 -2.462 -51.098 1.00 44.43 C ATOM 745 CE1 TYR A 50 -9.825 -1.130 -49.071 1.00 2.23 C ATOM 746 CE2 TYR A 50 -9.314 -1.381 -51.394 1.00 51.13 C ATOM 747 CZ TYR A 50 -9.971 -0.719 -50.380 1.00 62.13 C ATOM 748 OH TYR A 50 -10.781 0.352 -50.676 1.00 33.15 O ATOM 0 H TYR A 50 -5.289 -3.638 -51.139 1.00 14.34 H new ATOM 0 HA TYR A 50 -5.948 -3.107 -48.301 1.00 11.42 H new ATOM 0 HB2 TYR A 50 -7.505 -4.789 -50.309 1.00 61.52 H new ATOM 0 HB3 TYR A 50 -7.888 -4.617 -48.608 1.00 61.52 H new ATOM 0 HD1 TYR A 50 -8.900 -2.528 -47.753 1.00 71.34 H new ATOM 0 HD2 TYR A 50 -7.999 -2.980 -51.898 1.00 44.43 H new ATOM 0 HE1 TYR A 50 -10.342 -0.610 -48.278 1.00 2.23 H new ATOM 0 HE2 TYR A 50 -9.429 -1.055 -52.417 1.00 51.13 H new ATOM 0 HH TYR A 50 -10.773 0.511 -51.643 1.00 33.15 H new ATOM 758 N ASP A 51 -5.277 -5.500 -47.649 1.00 4.52 N ATOM 759 CA ASP A 51 -4.742 -6.804 -47.267 1.00 51.23 C ATOM 760 C ASP A 51 -5.743 -7.484 -46.330 1.00 52.23 C ATOM 761 O ASP A 51 -5.992 -7.008 -45.219 1.00 72.43 O ATOM 762 CB ASP A 51 -3.368 -6.674 -46.571 1.00 43.42 C ATOM 763 CG ASP A 51 -2.271 -6.093 -47.465 1.00 52.30 C ATOM 764 OD1 ASP A 51 -1.808 -6.791 -48.399 1.00 62.22 O ATOM 765 OD2 ASP A 51 -1.827 -4.946 -47.212 1.00 54.15 O ATOM 0 H ASP A 51 -5.674 -4.970 -46.873 1.00 4.52 H new ATOM 0 HA ASP A 51 -4.594 -7.402 -48.166 1.00 51.23 H new ATOM 0 HB2 ASP A 51 -3.477 -6.042 -45.690 1.00 43.42 H new ATOM 0 HB3 ASP A 51 -3.055 -7.658 -46.221 1.00 43.42 H new ATOM 770 N GLY A 52 -6.346 -8.572 -46.811 1.00 64.23 N ATOM 771 CA GLY A 52 -7.382 -9.268 -46.061 1.00 20.04 C ATOM 772 C GLY A 52 -6.824 -10.064 -44.897 1.00 41.33 C ATOM 773 O GLY A 52 -6.153 -11.078 -45.099 1.00 22.22 O ATOM 0 H GLY A 52 -6.132 -8.987 -47.718 1.00 64.23 H new ATOM 0 HA2 GLY A 52 -8.104 -8.542 -45.687 1.00 20.04 H new ATOM 0 HA3 GLY A 52 -7.921 -9.939 -46.730 1.00 20.04 H new ATOM 777 N ARG A 53 -7.121 -9.615 -43.682 1.00 44.32 N ATOM 778 CA ARG A 53 -6.573 -10.209 -42.465 1.00 1.42 C ATOM 779 C ARG A 53 -7.694 -10.685 -41.532 1.00 33.53 C ATOM 780 O ARG A 53 -8.708 -9.997 -41.339 1.00 63.13 O ATOM 781 CB ARG A 53 -5.682 -9.175 -41.763 1.00 71.31 C ATOM 782 CG ARG A 53 -4.932 -9.700 -40.544 1.00 52.10 C ATOM 783 CD ARG A 53 -4.016 -8.629 -39.963 1.00 42.02 C ATOM 784 NE ARG A 53 -3.219 -9.126 -38.838 1.00 21.24 N ATOM 785 CZ ARG A 53 -1.892 -8.996 -38.746 1.00 61.51 C ATOM 786 NH1 ARG A 53 -1.205 -8.375 -39.699 1.00 32.45 N ATOM 787 NH2 ARG A 53 -1.256 -9.477 -37.686 1.00 4.41 N ATOM 0 H ARG A 53 -7.748 -8.829 -43.512 1.00 44.32 H new ATOM 0 HA ARG A 53 -5.977 -11.083 -42.729 1.00 1.42 H new ATOM 0 HB2 ARG A 53 -4.957 -8.793 -42.482 1.00 71.31 H new ATOM 0 HB3 ARG A 53 -6.301 -8.332 -41.456 1.00 71.31 H new ATOM 0 HG2 ARG A 53 -5.645 -10.024 -39.786 1.00 52.10 H new ATOM 0 HG3 ARG A 53 -4.344 -10.574 -40.823 1.00 52.10 H new ATOM 0 HD2 ARG A 53 -3.349 -8.263 -40.743 1.00 42.02 H new ATOM 0 HD3 ARG A 53 -4.616 -7.781 -39.633 1.00 42.02 H new ATOM 0 HE ARG A 53 -3.707 -9.600 -38.078 1.00 21.24 H new ATOM 0 HH11 ARG A 53 -1.690 -7.992 -40.510 1.00 32.45 H new ATOM 0 HH12 ARG A 53 -0.192 -8.281 -39.619 1.00 32.45 H new ATOM 0 HH21 ARG A 53 -1.780 -9.944 -36.945 1.00 4.41 H new ATOM 0 HH22 ARG A 53 -0.243 -9.380 -37.611 1.00 4.41 H new ATOM 801 N PHE A 54 -7.506 -11.866 -40.958 1.00 54.13 N ATOM 802 CA PHE A 54 -8.480 -12.446 -40.042 1.00 71.03 C ATOM 803 C PHE A 54 -8.181 -11.995 -38.610 1.00 14.50 C ATOM 804 O PHE A 54 -7.027 -11.713 -38.275 1.00 62.12 O ATOM 805 CB PHE A 54 -8.456 -13.979 -40.139 1.00 75.12 C ATOM 806 CG PHE A 54 -8.637 -14.500 -41.544 1.00 4.21 C ATOM 807 CD1 PHE A 54 -9.744 -14.136 -42.298 1.00 43.03 C ATOM 808 CD2 PHE A 54 -7.697 -15.348 -42.113 1.00 10.32 C ATOM 809 CE1 PHE A 54 -9.909 -14.608 -43.587 1.00 64.24 C ATOM 810 CE2 PHE A 54 -7.857 -15.823 -43.401 1.00 10.31 C ATOM 811 CZ PHE A 54 -8.964 -15.453 -44.139 1.00 33.43 C ATOM 0 H PHE A 54 -6.681 -12.445 -41.112 1.00 54.13 H new ATOM 0 HA PHE A 54 -9.476 -12.100 -40.318 1.00 71.03 H new ATOM 0 HB2 PHE A 54 -7.508 -14.345 -39.745 1.00 75.12 H new ATOM 0 HB3 PHE A 54 -9.243 -14.387 -39.505 1.00 75.12 H new ATOM 0 HD1 PHE A 54 -10.486 -13.476 -41.873 1.00 43.03 H new ATOM 0 HD2 PHE A 54 -6.829 -15.641 -41.541 1.00 10.32 H new ATOM 0 HE1 PHE A 54 -10.775 -14.317 -44.162 1.00 64.24 H new ATOM 0 HE2 PHE A 54 -7.117 -16.483 -43.830 1.00 10.31 H new ATOM 0 HZ PHE A 54 -9.091 -15.823 -45.146 1.00 33.43 H new ATOM 821 N PRO A 55 -9.216 -11.921 -37.746 1.00 32.51 N ATOM 822 CA PRO A 55 -9.079 -11.426 -36.361 1.00 12.25 C ATOM 823 C PRO A 55 -8.076 -12.217 -35.512 1.00 74.21 C ATOM 824 O PRO A 55 -7.628 -11.735 -34.471 1.00 2.34 O ATOM 825 CB PRO A 55 -10.498 -11.572 -35.785 1.00 42.22 C ATOM 826 CG PRO A 55 -11.393 -11.596 -36.978 1.00 14.43 C ATOM 827 CD PRO A 55 -10.611 -12.297 -38.053 1.00 41.45 C ATOM 0 HA PRO A 55 -8.690 -10.408 -36.351 1.00 12.25 H new ATOM 0 HB2 PRO A 55 -10.595 -12.486 -35.199 1.00 42.22 H new ATOM 0 HB3 PRO A 55 -10.744 -10.742 -35.123 1.00 42.22 H new ATOM 0 HG2 PRO A 55 -12.322 -12.124 -36.761 1.00 14.43 H new ATOM 0 HG3 PRO A 55 -11.664 -10.586 -37.285 1.00 14.43 H new ATOM 0 HD2 PRO A 55 -10.755 -13.377 -38.018 1.00 41.45 H new ATOM 0 HD3 PRO A 55 -10.908 -11.968 -39.049 1.00 41.45 H new ATOM 835 N ASP A 56 -7.725 -13.426 -35.949 1.00 72.30 N ATOM 836 CA ASP A 56 -6.796 -14.275 -35.194 1.00 2.21 C ATOM 837 C ASP A 56 -5.348 -13.890 -35.497 1.00 31.10 C ATOM 838 O ASP A 56 -4.424 -14.284 -34.778 1.00 51.45 O ATOM 839 CB ASP A 56 -7.024 -15.761 -35.516 1.00 33.21 C ATOM 840 CG ASP A 56 -6.475 -16.162 -36.876 1.00 3.34 C ATOM 841 OD1 ASP A 56 -6.963 -15.637 -37.895 1.00 33.45 O ATOM 842 OD2 ASP A 56 -5.545 -16.995 -36.930 1.00 1.05 O ATOM 0 H ASP A 56 -8.066 -13.840 -36.816 1.00 72.30 H new ATOM 0 HA ASP A 56 -6.987 -14.118 -34.132 1.00 2.21 H new ATOM 0 HB2 ASP A 56 -6.553 -16.371 -34.745 1.00 33.21 H new ATOM 0 HB3 ASP A 56 -8.092 -15.975 -35.483 1.00 33.21 H new ATOM 847 N GLY A 57 -5.159 -13.118 -36.564 1.00 5.43 N ATOM 848 CA GLY A 57 -3.828 -12.674 -36.947 1.00 3.42 C ATOM 849 C GLY A 57 -3.308 -13.397 -38.172 1.00 52.54 C ATOM 850 O GLY A 57 -2.193 -13.132 -38.633 1.00 13.40 O ATOM 0 H GLY A 57 -5.908 -12.790 -37.174 1.00 5.43 H new ATOM 0 HA2 GLY A 57 -3.848 -11.602 -37.143 1.00 3.42 H new ATOM 0 HA3 GLY A 57 -3.141 -12.834 -36.116 1.00 3.42 H new ATOM 854 N LYS A 58 -4.105 -14.320 -38.695 1.00 22.23 N ATOM 855 CA LYS A 58 -3.752 -15.051 -39.906 1.00 64.14 C ATOM 856 C LYS A 58 -4.367 -14.358 -41.118 1.00 44.42 C ATOM 857 O LYS A 58 -5.337 -13.615 -40.985 1.00 32.12 O ATOM 858 CB LYS A 58 -4.261 -16.498 -39.813 1.00 2.04 C ATOM 859 CG LYS A 58 -3.804 -17.403 -40.957 1.00 64.13 C ATOM 860 CD LYS A 58 -4.443 -18.794 -40.902 1.00 2.12 C ATOM 861 CE LYS A 58 -4.148 -19.530 -39.595 1.00 51.22 C ATOM 862 NZ LYS A 58 -5.062 -19.129 -38.489 1.00 12.14 N ATOM 0 H LYS A 58 -5.007 -14.582 -38.296 1.00 22.23 H new ATOM 0 HA LYS A 58 -2.667 -15.067 -40.013 1.00 64.14 H new ATOM 0 HB2 LYS A 58 -3.926 -16.928 -38.869 1.00 2.04 H new ATOM 0 HB3 LYS A 58 -5.351 -16.486 -39.788 1.00 2.04 H new ATOM 0 HG2 LYS A 58 -4.051 -16.932 -41.908 1.00 64.13 H new ATOM 0 HG3 LYS A 58 -2.719 -17.504 -40.923 1.00 64.13 H new ATOM 0 HD2 LYS A 58 -5.522 -18.698 -41.024 1.00 2.12 H new ATOM 0 HD3 LYS A 58 -4.079 -19.389 -41.739 1.00 2.12 H new ATOM 0 HE2 LYS A 58 -4.234 -20.604 -39.760 1.00 51.22 H new ATOM 0 HE3 LYS A 58 -3.118 -19.335 -39.298 1.00 51.22 H new ATOM 0 HZ1 LYS A 58 -5.299 -19.963 -37.915 1.00 12.14 H new ATOM 0 HZ2 LYS A 58 -4.593 -18.419 -37.891 1.00 12.14 H new ATOM 0 HZ3 LYS A 58 -5.933 -18.724 -38.888 1.00 12.14 H new ATOM 876 N GLN A 59 -3.794 -14.587 -42.292 1.00 62.31 N ATOM 877 CA GLN A 59 -4.364 -14.079 -43.532 1.00 30.32 C ATOM 878 C GLN A 59 -4.039 -15.032 -44.676 1.00 0.55 C ATOM 879 O GLN A 59 -2.908 -15.509 -44.795 1.00 71.44 O ATOM 880 CB GLN A 59 -3.863 -12.656 -43.822 1.00 41.23 C ATOM 881 CG GLN A 59 -2.362 -12.538 -44.072 1.00 10.35 C ATOM 882 CD GLN A 59 -1.894 -11.091 -44.118 1.00 72.33 C ATOM 883 OE1 GLN A 59 -2.441 -10.229 -43.431 1.00 24.21 O ATOM 884 NE2 GLN A 59 -0.892 -10.810 -44.933 1.00 55.00 N ATOM 0 H GLN A 59 -2.934 -15.122 -42.411 1.00 62.31 H new ATOM 0 HA GLN A 59 -5.448 -14.023 -43.430 1.00 30.32 H new ATOM 0 HB2 GLN A 59 -4.392 -12.271 -44.694 1.00 41.23 H new ATOM 0 HB3 GLN A 59 -4.127 -12.016 -42.980 1.00 41.23 H new ATOM 0 HG2 GLN A 59 -1.823 -13.067 -43.286 1.00 10.35 H new ATOM 0 HG3 GLN A 59 -2.114 -13.028 -45.014 1.00 10.35 H new ATOM 0 HE21 GLN A 59 -0.463 -11.551 -45.488 1.00 55.00 H new ATOM 0 HE22 GLN A 59 -0.548 -9.853 -45.007 1.00 55.00 H new ATOM 893 N PHE A 60 -5.042 -15.327 -45.496 1.00 4.41 N ATOM 894 CA PHE A 60 -4.904 -16.309 -46.568 1.00 50.42 C ATOM 895 C PHE A 60 -3.976 -15.801 -47.671 1.00 13.13 C ATOM 896 O PHE A 60 -3.081 -16.519 -48.123 1.00 51.22 O ATOM 897 CB PHE A 60 -6.283 -16.656 -47.155 1.00 41.42 C ATOM 898 CG PHE A 60 -6.228 -17.623 -48.316 1.00 61.13 C ATOM 899 CD1 PHE A 60 -6.010 -18.977 -48.099 1.00 12.31 C ATOM 900 CD2 PHE A 60 -6.388 -17.177 -49.625 1.00 40.54 C ATOM 901 CE1 PHE A 60 -5.953 -19.863 -49.161 1.00 10.14 C ATOM 902 CE2 PHE A 60 -6.331 -18.060 -50.686 1.00 73.53 C ATOM 903 CZ PHE A 60 -6.114 -19.404 -50.454 1.00 13.11 C ATOM 0 H PHE A 60 -5.965 -14.898 -45.439 1.00 4.41 H new ATOM 0 HA PHE A 60 -4.461 -17.209 -46.142 1.00 50.42 H new ATOM 0 HB2 PHE A 60 -6.905 -17.083 -46.368 1.00 41.42 H new ATOM 0 HB3 PHE A 60 -6.769 -15.737 -47.483 1.00 41.42 H new ATOM 0 HD1 PHE A 60 -5.884 -19.343 -47.091 1.00 12.31 H new ATOM 0 HD2 PHE A 60 -6.559 -16.127 -49.813 1.00 40.54 H new ATOM 0 HE1 PHE A 60 -5.783 -20.914 -48.979 1.00 10.14 H new ATOM 0 HE2 PHE A 60 -6.456 -17.699 -51.696 1.00 73.53 H new ATOM 0 HZ PHE A 60 -6.070 -20.095 -51.282 1.00 13.11 H new ATOM 913 N ASP A 61 -4.189 -14.561 -48.096 1.00 72.13 N ATOM 914 CA ASP A 61 -3.452 -14.000 -49.225 1.00 21.25 C ATOM 915 C ASP A 61 -2.868 -12.640 -48.872 1.00 45.30 C ATOM 916 O ASP A 61 -3.564 -11.775 -48.337 1.00 20.32 O ATOM 917 CB ASP A 61 -4.373 -13.867 -50.445 1.00 71.44 C ATOM 918 CG ASP A 61 -3.665 -13.275 -51.656 1.00 31.53 C ATOM 919 OD1 ASP A 61 -2.779 -13.954 -52.217 1.00 42.41 O ATOM 920 OD2 ASP A 61 -3.995 -12.136 -52.057 1.00 45.10 O ATOM 0 H ASP A 61 -4.866 -13.924 -47.676 1.00 72.13 H new ATOM 0 HA ASP A 61 -2.632 -14.678 -49.464 1.00 21.25 H new ATOM 0 HB2 ASP A 61 -4.768 -14.849 -50.705 1.00 71.44 H new ATOM 0 HB3 ASP A 61 -5.225 -13.239 -50.185 1.00 71.44 H new ATOM 925 N SER A 62 -1.588 -12.464 -49.167 1.00 2.52 N ATOM 926 CA SER A 62 -0.917 -11.189 -48.969 1.00 22.13 C ATOM 927 C SER A 62 -0.718 -10.505 -50.322 1.00 22.13 C ATOM 928 O SER A 62 0.329 -10.653 -50.957 1.00 25.20 O ATOM 929 CB SER A 62 0.429 -11.402 -48.265 1.00 73.41 C ATOM 930 OG SER A 62 0.267 -12.142 -47.064 1.00 51.41 O ATOM 0 H SER A 62 -0.989 -13.197 -49.548 1.00 2.52 H new ATOM 0 HA SER A 62 -1.532 -10.549 -48.336 1.00 22.13 H new ATOM 0 HB2 SER A 62 1.112 -11.929 -48.931 1.00 73.41 H new ATOM 0 HB3 SER A 62 0.883 -10.436 -48.042 1.00 73.41 H new ATOM 0 HG SER A 62 1.140 -12.265 -46.635 1.00 51.41 H new ATOM 936 N SER A 63 -1.739 -9.776 -50.764 1.00 2.54 N ATOM 937 CA SER A 63 -1.722 -9.117 -52.067 1.00 61.15 C ATOM 938 C SER A 63 -0.520 -8.177 -52.186 1.00 30.33 C ATOM 939 O SER A 63 0.000 -7.945 -53.282 1.00 20.53 O ATOM 940 CB SER A 63 -3.026 -8.341 -52.269 1.00 5.12 C ATOM 941 OG SER A 63 -3.204 -7.387 -51.236 1.00 11.23 O ATOM 0 H SER A 63 -2.597 -9.626 -50.233 1.00 2.54 H new ATOM 0 HA SER A 63 -1.633 -9.878 -52.842 1.00 61.15 H new ATOM 0 HB2 SER A 63 -3.011 -7.839 -53.236 1.00 5.12 H new ATOM 0 HB3 SER A 63 -3.869 -9.032 -52.282 1.00 5.12 H new ATOM 0 HG SER A 63 -4.143 -7.108 -51.207 1.00 11.23 H new ATOM 947 N ARG A 64 -0.081 -7.648 -51.040 1.00 62.05 N ATOM 948 CA ARG A 64 1.076 -6.758 -50.979 1.00 51.31 C ATOM 949 C ARG A 64 2.305 -7.397 -51.633 1.00 11.31 C ATOM 950 O ARG A 64 3.138 -6.703 -52.213 1.00 41.21 O ATOM 951 CB ARG A 64 1.385 -6.392 -49.522 1.00 11.31 C ATOM 952 CG ARG A 64 1.730 -7.592 -48.638 1.00 31.34 C ATOM 953 CD ARG A 64 1.995 -7.178 -47.196 1.00 61.25 C ATOM 954 NE ARG A 64 0.829 -6.533 -46.586 1.00 63.21 N ATOM 955 CZ ARG A 64 0.783 -6.103 -45.323 1.00 44.35 C ATOM 956 NH1 ARG A 64 1.846 -6.220 -44.531 1.00 70.45 N ATOM 957 NH2 ARG A 64 -0.325 -5.543 -44.862 1.00 74.42 N ATOM 0 H ARG A 64 -0.517 -7.825 -50.135 1.00 62.05 H new ATOM 0 HA ARG A 64 0.832 -5.851 -51.533 1.00 51.31 H new ATOM 0 HB2 ARG A 64 2.218 -5.689 -49.504 1.00 11.31 H new ATOM 0 HB3 ARG A 64 0.524 -5.877 -49.097 1.00 11.31 H new ATOM 0 HG2 ARG A 64 0.910 -8.310 -48.665 1.00 31.34 H new ATOM 0 HG3 ARG A 64 2.609 -8.097 -49.038 1.00 31.34 H new ATOM 0 HD2 ARG A 64 2.270 -8.056 -46.612 1.00 61.25 H new ATOM 0 HD3 ARG A 64 2.844 -6.495 -47.165 1.00 61.25 H new ATOM 0 HE ARG A 64 -0.001 -6.404 -47.164 1.00 63.21 H new ATOM 0 HH11 ARG A 64 2.704 -6.641 -44.888 1.00 70.45 H new ATOM 0 HH12 ARG A 64 1.803 -5.889 -43.567 1.00 70.45 H new ATOM 0 HH21 ARG A 64 -1.137 -5.442 -45.471 1.00 74.42 H new ATOM 0 HH22 ARG A 64 -0.366 -5.212 -43.898 1.00 74.42 H new ATOM 971 N SER A 65 2.399 -8.724 -51.548 1.00 10.31 N ATOM 972 CA SER A 65 3.527 -9.464 -52.110 1.00 43.24 C ATOM 973 C SER A 65 3.639 -9.219 -53.615 1.00 30.11 C ATOM 974 O SER A 65 4.742 -9.103 -54.158 1.00 40.21 O ATOM 975 CB SER A 65 3.367 -10.965 -51.827 1.00 13.31 C ATOM 976 OG SER A 65 4.446 -11.714 -52.362 1.00 52.33 O ATOM 0 H SER A 65 1.701 -9.312 -51.091 1.00 10.31 H new ATOM 0 HA SER A 65 4.442 -9.110 -51.636 1.00 43.24 H new ATOM 0 HB2 SER A 65 3.307 -11.129 -50.751 1.00 13.31 H new ATOM 0 HB3 SER A 65 2.429 -11.319 -52.256 1.00 13.31 H new ATOM 0 HG SER A 65 4.315 -12.665 -52.163 1.00 52.33 H new ATOM 982 N ARG A 66 2.487 -9.120 -54.278 1.00 45.31 N ATOM 983 CA ARG A 66 2.439 -8.918 -55.725 1.00 14.00 C ATOM 984 C ARG A 66 2.670 -7.450 -56.069 1.00 1.23 C ATOM 985 O ARG A 66 2.870 -7.102 -57.234 1.00 33.32 O ATOM 986 CB ARG A 66 1.085 -9.380 -56.285 1.00 41.14 C ATOM 987 CG ARG A 66 0.776 -10.853 -56.029 1.00 42.33 C ATOM 988 CD ARG A 66 -0.599 -11.251 -56.559 1.00 1.51 C ATOM 989 NE ARG A 66 -0.699 -11.122 -58.016 1.00 14.23 N ATOM 990 CZ ARG A 66 -1.769 -11.492 -58.725 1.00 13.50 C ATOM 991 NH1 ARG A 66 -2.850 -11.961 -58.114 1.00 2.55 N ATOM 992 NH2 ARG A 66 -1.768 -11.369 -60.041 1.00 75.44 N ATOM 0 H ARG A 66 1.571 -9.177 -53.833 1.00 45.31 H new ATOM 0 HA ARG A 66 3.231 -9.513 -56.179 1.00 14.00 H new ATOM 0 HB2 ARG A 66 0.295 -8.772 -55.844 1.00 41.14 H new ATOM 0 HB3 ARG A 66 1.066 -9.197 -57.359 1.00 41.14 H new ATOM 0 HG2 ARG A 66 1.539 -11.471 -56.502 1.00 42.33 H new ATOM 0 HG3 ARG A 66 0.823 -11.052 -54.958 1.00 42.33 H new ATOM 0 HD2 ARG A 66 -0.810 -12.282 -56.274 1.00 1.51 H new ATOM 0 HD3 ARG A 66 -1.360 -10.628 -56.089 1.00 1.51 H new ATOM 0 HE ARG A 66 0.096 -10.726 -58.518 1.00 14.23 H new ATOM 0 HH11 ARG A 66 -2.867 -12.041 -57.097 1.00 2.55 H new ATOM 0 HH12 ARG A 66 -3.664 -12.242 -58.661 1.00 2.55 H new ATOM 0 HH21 ARG A 66 -0.949 -10.991 -60.517 1.00 75.44 H new ATOM 0 HH22 ARG A 66 -2.586 -11.652 -60.580 1.00 75.44 H new ATOM 1006 N GLY A 67 2.631 -6.594 -55.047 1.00 34.51 N ATOM 1007 CA GLY A 67 2.790 -5.164 -55.253 1.00 34.10 C ATOM 1008 C GLY A 67 1.685 -4.585 -56.119 1.00 63.33 C ATOM 1009 O GLY A 67 1.826 -3.495 -56.672 1.00 1.24 O ATOM 0 H GLY A 67 2.491 -6.869 -54.075 1.00 34.51 H new ATOM 0 HA2 GLY A 67 2.796 -4.658 -54.288 1.00 34.10 H new ATOM 0 HA3 GLY A 67 3.755 -4.971 -55.721 1.00 34.10 H new ATOM 1013 N LYS A 68 0.579 -5.320 -56.222 1.00 75.34 N ATOM 1014 CA LYS A 68 -0.532 -4.941 -57.086 1.00 45.14 C ATOM 1015 C LYS A 68 -1.425 -3.912 -56.386 1.00 23.21 C ATOM 1016 O LYS A 68 -1.972 -4.183 -55.309 1.00 4.34 O ATOM 1017 CB LYS A 68 -1.340 -6.192 -57.469 1.00 40.24 C ATOM 1018 CG LYS A 68 -2.385 -5.953 -58.555 1.00 60.33 C ATOM 1019 CD LYS A 68 -3.083 -7.249 -58.964 1.00 74.22 C ATOM 1020 CE LYS A 68 -4.038 -7.033 -60.134 1.00 64.14 C ATOM 1021 NZ LYS A 68 -5.088 -6.027 -59.823 1.00 71.10 N ATOM 0 H LYS A 68 0.430 -6.190 -55.711 1.00 75.34 H new ATOM 0 HA LYS A 68 -0.139 -4.485 -57.995 1.00 45.14 H new ATOM 0 HB2 LYS A 68 -0.651 -6.966 -57.807 1.00 40.24 H new ATOM 0 HB3 LYS A 68 -1.839 -6.576 -56.579 1.00 40.24 H new ATOM 0 HG2 LYS A 68 -3.126 -5.239 -58.196 1.00 60.33 H new ATOM 0 HG3 LYS A 68 -1.908 -5.506 -59.427 1.00 60.33 H new ATOM 0 HD2 LYS A 68 -2.336 -7.994 -59.238 1.00 74.22 H new ATOM 0 HD3 LYS A 68 -3.635 -7.649 -58.113 1.00 74.22 H new ATOM 0 HE2 LYS A 68 -3.473 -6.708 -61.007 1.00 64.14 H new ATOM 0 HE3 LYS A 68 -4.510 -7.980 -60.395 1.00 64.14 H new ATOM 0 HZ1 LYS A 68 -5.791 -6.011 -60.589 1.00 71.10 H new ATOM 0 HZ2 LYS A 68 -5.556 -6.279 -58.929 1.00 71.10 H new ATOM 0 HZ3 LYS A 68 -4.652 -5.087 -59.733 1.00 71.10 H new ATOM 1035 N PRO A 69 -1.558 -2.707 -56.970 1.00 1.43 N ATOM 1036 CA PRO A 69 -2.397 -1.646 -56.423 1.00 41.05 C ATOM 1037 C PRO A 69 -3.842 -1.728 -56.926 1.00 63.34 C ATOM 1038 O PRO A 69 -4.129 -2.391 -57.927 1.00 73.21 O ATOM 1039 CB PRO A 69 -1.708 -0.386 -56.948 1.00 65.54 C ATOM 1040 CG PRO A 69 -1.176 -0.785 -58.288 1.00 33.42 C ATOM 1041 CD PRO A 69 -0.878 -2.270 -58.211 1.00 34.41 C ATOM 0 HA PRO A 69 -2.483 -1.691 -55.337 1.00 41.05 H new ATOM 0 HB2 PRO A 69 -2.408 0.445 -57.030 1.00 65.54 H new ATOM 0 HB3 PRO A 69 -0.907 -0.064 -56.282 1.00 65.54 H new ATOM 0 HG2 PRO A 69 -1.904 -0.576 -59.072 1.00 33.42 H new ATOM 0 HG3 PRO A 69 -0.275 -0.221 -58.531 1.00 33.42 H new ATOM 0 HD2 PRO A 69 -1.260 -2.800 -59.084 1.00 34.41 H new ATOM 0 HD3 PRO A 69 0.194 -2.460 -58.167 1.00 34.41 H new ATOM 1049 N PHE A 70 -4.740 -1.050 -56.224 1.00 41.12 N ATOM 1050 CA PHE A 70 -6.152 -1.002 -56.589 1.00 52.04 C ATOM 1051 C PHE A 70 -6.576 0.452 -56.782 1.00 55.23 C ATOM 1052 O PHE A 70 -6.517 1.252 -55.849 1.00 31.10 O ATOM 1053 CB PHE A 70 -7.003 -1.675 -55.497 1.00 51.25 C ATOM 1054 CG PHE A 70 -8.483 -1.707 -55.798 1.00 44.01 C ATOM 1055 CD1 PHE A 70 -9.018 -2.693 -56.619 1.00 50.33 C ATOM 1056 CD2 PHE A 70 -9.340 -0.753 -55.264 1.00 54.02 C ATOM 1057 CE1 PHE A 70 -10.371 -2.725 -56.898 1.00 71.23 C ATOM 1058 CE2 PHE A 70 -10.695 -0.782 -55.541 1.00 42.20 C ATOM 1059 CZ PHE A 70 -11.211 -1.768 -56.359 1.00 20.44 C ATOM 0 H PHE A 70 -4.511 -0.517 -55.385 1.00 41.12 H new ATOM 0 HA PHE A 70 -6.306 -1.543 -57.523 1.00 52.04 H new ATOM 0 HB2 PHE A 70 -6.650 -2.697 -55.355 1.00 51.25 H new ATOM 0 HB3 PHE A 70 -6.846 -1.150 -54.555 1.00 51.25 H new ATOM 0 HD1 PHE A 70 -8.368 -3.443 -57.044 1.00 50.33 H new ATOM 0 HD2 PHE A 70 -8.943 0.021 -54.624 1.00 54.02 H new ATOM 0 HE1 PHE A 70 -10.772 -3.498 -57.537 1.00 71.23 H new ATOM 0 HE2 PHE A 70 -11.349 -0.034 -55.118 1.00 42.20 H new ATOM 0 HZ PHE A 70 -12.268 -1.791 -56.577 1.00 20.44 H new ATOM 1069 N GLN A 71 -6.978 0.796 -57.997 1.00 45.33 N ATOM 1070 CA GLN A 71 -7.372 2.163 -58.323 1.00 52.35 C ATOM 1071 C GLN A 71 -8.884 2.256 -58.492 1.00 12.44 C ATOM 1072 O GLN A 71 -9.505 1.348 -59.048 1.00 73.44 O ATOM 1073 CB GLN A 71 -6.680 2.629 -59.611 1.00 41.45 C ATOM 1074 CG GLN A 71 -5.156 2.614 -59.536 1.00 24.22 C ATOM 1075 CD GLN A 71 -4.505 3.138 -60.805 1.00 52.53 C ATOM 1076 OE1 GLN A 71 -5.057 3.007 -61.900 1.00 33.44 O ATOM 1077 NE2 GLN A 71 -3.331 3.731 -60.674 1.00 75.03 N ATOM 0 H GLN A 71 -7.041 0.144 -58.779 1.00 45.33 H new ATOM 0 HA GLN A 71 -7.065 2.810 -57.501 1.00 52.35 H new ATOM 0 HB2 GLN A 71 -6.999 1.990 -60.435 1.00 41.45 H new ATOM 0 HB3 GLN A 71 -7.012 3.641 -59.844 1.00 41.45 H new ATOM 0 HG2 GLN A 71 -4.831 3.218 -58.689 1.00 24.22 H new ATOM 0 HG3 GLN A 71 -4.815 1.596 -59.350 1.00 24.22 H new ATOM 0 HE21 GLN A 71 -2.905 3.821 -59.752 1.00 75.03 H new ATOM 0 HE22 GLN A 71 -2.851 4.099 -61.495 1.00 75.03 H new ATOM 1086 N PHE A 72 -9.468 3.348 -58.010 1.00 73.33 N ATOM 1087 CA PHE A 72 -10.896 3.599 -58.189 1.00 2.55 C ATOM 1088 C PHE A 72 -11.188 5.093 -58.073 1.00 20.34 C ATOM 1089 O PHE A 72 -10.331 5.870 -57.645 1.00 61.22 O ATOM 1090 CB PHE A 72 -11.737 2.805 -57.167 1.00 25.13 C ATOM 1091 CG PHE A 72 -11.633 3.303 -55.741 1.00 43.44 C ATOM 1092 CD1 PHE A 72 -10.550 2.963 -54.943 1.00 1.40 C ATOM 1093 CD2 PHE A 72 -12.631 4.103 -55.197 1.00 73.40 C ATOM 1094 CE1 PHE A 72 -10.465 3.415 -53.638 1.00 5.31 C ATOM 1095 CE2 PHE A 72 -12.548 4.556 -53.895 1.00 1.11 C ATOM 1096 CZ PHE A 72 -11.465 4.211 -53.115 1.00 32.03 C ATOM 0 H PHE A 72 -8.975 4.075 -57.492 1.00 73.33 H new ATOM 0 HA PHE A 72 -11.176 3.260 -59.187 1.00 2.55 H new ATOM 0 HB2 PHE A 72 -12.782 2.837 -57.474 1.00 25.13 H new ATOM 0 HB3 PHE A 72 -11.428 1.760 -57.196 1.00 25.13 H new ATOM 0 HD1 PHE A 72 -9.765 2.339 -55.345 1.00 1.40 H new ATOM 0 HD2 PHE A 72 -13.484 4.374 -55.801 1.00 73.40 H new ATOM 0 HE1 PHE A 72 -9.616 3.145 -53.028 1.00 5.31 H new ATOM 0 HE2 PHE A 72 -13.330 5.180 -53.488 1.00 1.11 H new ATOM 0 HZ PHE A 72 -11.399 4.563 -52.096 1.00 32.03 H new ATOM 1106 N THR A 73 -12.392 5.487 -58.464 1.00 51.11 N ATOM 1107 CA THR A 73 -12.809 6.878 -58.391 1.00 1.20 C ATOM 1108 C THR A 73 -13.282 7.216 -56.978 1.00 62.13 C ATOM 1109 O THR A 73 -14.334 6.743 -56.539 1.00 74.23 O ATOM 1110 CB THR A 73 -13.946 7.160 -59.400 1.00 52.41 C ATOM 1111 OG1 THR A 73 -13.583 6.649 -60.692 1.00 54.54 O ATOM 1112 CG2 THR A 73 -14.237 8.656 -59.505 1.00 75.20 C ATOM 0 H THR A 73 -13.101 4.856 -58.838 1.00 51.11 H new ATOM 0 HA THR A 73 -11.952 7.503 -58.642 1.00 1.20 H new ATOM 0 HB THR A 73 -14.847 6.662 -59.043 1.00 52.41 H new ATOM 0 HG1 THR A 73 -14.306 6.827 -61.329 1.00 54.54 H new ATOM 0 HG21 THR A 73 -15.041 8.821 -60.222 1.00 75.20 H new ATOM 0 HG22 THR A 73 -14.537 9.038 -58.529 1.00 75.20 H new ATOM 0 HG23 THR A 73 -13.340 9.179 -59.839 1.00 75.20 H new ATOM 1120 N LEU A 74 -12.493 8.009 -56.259 1.00 41.42 N ATOM 1121 CA LEU A 74 -12.848 8.413 -54.904 1.00 2.01 C ATOM 1122 C LEU A 74 -14.144 9.217 -54.930 1.00 50.22 C ATOM 1123 O LEU A 74 -14.182 10.330 -55.456 1.00 44.43 O ATOM 1124 CB LEU A 74 -11.720 9.238 -54.264 1.00 4.02 C ATOM 1125 CG LEU A 74 -11.949 9.638 -52.794 1.00 75.13 C ATOM 1126 CD1 LEU A 74 -12.152 8.403 -51.919 1.00 51.31 C ATOM 1127 CD2 LEU A 74 -10.785 10.477 -52.272 1.00 40.31 C ATOM 0 H LEU A 74 -11.605 8.384 -56.592 1.00 41.42 H new ATOM 0 HA LEU A 74 -12.993 7.517 -54.300 1.00 2.01 H new ATOM 0 HB2 LEU A 74 -10.794 8.667 -54.328 1.00 4.02 H new ATOM 0 HB3 LEU A 74 -11.577 10.145 -54.852 1.00 4.02 H new ATOM 0 HG LEU A 74 -12.855 10.242 -52.748 1.00 75.13 H new ATOM 0 HD11 LEU A 74 -12.312 8.711 -50.886 1.00 51.31 H new ATOM 0 HD12 LEU A 74 -13.021 7.847 -52.270 1.00 51.31 H new ATOM 0 HD13 LEU A 74 -11.268 7.768 -51.976 1.00 51.31 H new ATOM 0 HD21 LEU A 74 -10.969 10.748 -51.232 1.00 40.31 H new ATOM 0 HD22 LEU A 74 -9.862 9.901 -52.339 1.00 40.31 H new ATOM 0 HD23 LEU A 74 -10.692 11.383 -52.871 1.00 40.31 H new ATOM 1139 N GLY A 75 -15.204 8.630 -54.388 1.00 21.12 N ATOM 1140 CA GLY A 75 -16.513 9.254 -54.418 1.00 51.53 C ATOM 1141 C GLY A 75 -17.550 8.324 -55.013 1.00 33.31 C ATOM 1142 O GLY A 75 -18.744 8.448 -54.731 1.00 41.10 O ATOM 0 H GLY A 75 -15.179 7.722 -53.923 1.00 21.12 H new ATOM 0 HA2 GLY A 75 -16.809 9.533 -53.407 1.00 51.53 H new ATOM 0 HA3 GLY A 75 -16.467 10.173 -55.002 1.00 51.53 H new ATOM 1146 N ALA A 76 -17.087 7.387 -55.836 1.00 23.41 N ATOM 1147 CA ALA A 76 -17.965 6.398 -56.453 1.00 10.02 C ATOM 1148 C ALA A 76 -18.425 5.376 -55.418 1.00 2.44 C ATOM 1149 O ALA A 76 -17.665 5.014 -54.517 1.00 74.43 O ATOM 1150 CB ALA A 76 -17.257 5.702 -57.613 1.00 13.12 C ATOM 0 H ALA A 76 -16.104 7.292 -56.092 1.00 23.41 H new ATOM 0 HA ALA A 76 -18.842 6.913 -56.845 1.00 10.02 H new ATOM 0 HB1 ALA A 76 -17.927 4.968 -58.061 1.00 13.12 H new ATOM 0 HB2 ALA A 76 -16.975 6.441 -58.363 1.00 13.12 H new ATOM 0 HB3 ALA A 76 -16.363 5.199 -57.245 1.00 13.12 H new ATOM 1156 N GLY A 77 -19.659 4.905 -55.560 1.00 45.30 N ATOM 1157 CA GLY A 77 -20.233 3.969 -54.605 1.00 54.35 C ATOM 1158 C GLY A 77 -19.744 2.541 -54.802 1.00 33.32 C ATOM 1159 O GLY A 77 -20.534 1.595 -54.756 1.00 54.41 O ATOM 0 H GLY A 77 -20.280 5.157 -56.329 1.00 45.30 H new ATOM 0 HA2 GLY A 77 -19.988 4.295 -53.594 1.00 54.35 H new ATOM 0 HA3 GLY A 77 -21.319 3.990 -54.692 1.00 54.35 H new ATOM 1163 N GLU A 78 -18.444 2.387 -55.026 1.00 32.55 N ATOM 1164 CA GLU A 78 -17.834 1.071 -55.181 1.00 75.44 C ATOM 1165 C GLU A 78 -17.546 0.461 -53.816 1.00 54.02 C ATOM 1166 O GLU A 78 -17.882 -0.696 -53.550 1.00 2.52 O ATOM 1167 CB GLU A 78 -16.531 1.177 -55.993 1.00 2.50 C ATOM 1168 CG GLU A 78 -16.749 1.472 -57.473 1.00 4.04 C ATOM 1169 CD GLU A 78 -17.488 0.347 -58.181 1.00 63.04 C ATOM 1170 OE1 GLU A 78 -16.852 -0.678 -58.501 1.00 1.53 O ATOM 1171 OE2 GLU A 78 -18.711 0.472 -58.398 1.00 75.43 O ATOM 0 H GLU A 78 -17.787 3.164 -55.105 1.00 32.55 H new ATOM 0 HA GLU A 78 -18.531 0.427 -55.717 1.00 75.44 H new ATOM 0 HB2 GLU A 78 -15.909 1.963 -55.563 1.00 2.50 H new ATOM 0 HB3 GLU A 78 -15.977 0.243 -55.896 1.00 2.50 H new ATOM 0 HG2 GLU A 78 -17.315 2.398 -57.578 1.00 4.04 H new ATOM 0 HG3 GLU A 78 -15.785 1.631 -57.956 1.00 4.04 H new ATOM 1178 N VAL A 79 -16.939 1.261 -52.948 1.00 13.45 N ATOM 1179 CA VAL A 79 -16.534 0.805 -51.624 1.00 1.34 C ATOM 1180 C VAL A 79 -17.599 1.141 -50.581 1.00 20.50 C ATOM 1181 O VAL A 79 -18.480 1.972 -50.819 1.00 12.22 O ATOM 1182 CB VAL A 79 -15.182 1.436 -51.201 1.00 22.51 C ATOM 1183 CG1 VAL A 79 -14.078 1.074 -52.194 1.00 2.53 C ATOM 1184 CG2 VAL A 79 -15.312 2.953 -51.056 1.00 32.01 C ATOM 0 H VAL A 79 -16.715 2.237 -53.140 1.00 13.45 H new ATOM 0 HA VAL A 79 -16.415 -0.277 -51.678 1.00 1.34 H new ATOM 0 HB VAL A 79 -14.907 1.027 -50.229 1.00 22.51 H new ATOM 0 HG11 VAL A 79 -13.139 1.528 -51.876 1.00 2.53 H new ATOM 0 HG12 VAL A 79 -13.963 -0.009 -52.231 1.00 2.53 H new ATOM 0 HG13 VAL A 79 -14.343 1.445 -53.184 1.00 2.53 H new ATOM 0 HG21 VAL A 79 -14.351 3.374 -50.759 1.00 32.01 H new ATOM 0 HG22 VAL A 79 -15.618 3.385 -52.009 1.00 32.01 H new ATOM 0 HG23 VAL A 79 -16.059 3.183 -50.297 1.00 32.01 H new ATOM 1194 N ILE A 80 -17.522 0.478 -49.434 1.00 75.42 N ATOM 1195 CA ILE A 80 -18.414 0.767 -48.317 1.00 23.41 C ATOM 1196 C ILE A 80 -17.914 2.001 -47.569 1.00 60.52 C ATOM 1197 O ILE A 80 -16.733 2.347 -47.661 1.00 13.14 O ATOM 1198 CB ILE A 80 -18.498 -0.428 -47.331 1.00 73.33 C ATOM 1199 CG1 ILE A 80 -17.122 -0.694 -46.691 1.00 72.25 C ATOM 1200 CG2 ILE A 80 -19.018 -1.676 -48.043 1.00 24.01 C ATOM 1201 CD1 ILE A 80 -17.112 -1.812 -45.666 1.00 43.25 C ATOM 0 H ILE A 80 -16.849 -0.266 -49.252 1.00 75.42 H new ATOM 0 HA ILE A 80 -19.410 0.947 -48.721 1.00 23.41 H new ATOM 0 HB ILE A 80 -19.200 -0.174 -46.537 1.00 73.33 H new ATOM 0 HG12 ILE A 80 -16.409 -0.934 -47.479 1.00 72.25 H new ATOM 0 HG13 ILE A 80 -16.774 0.222 -46.214 1.00 72.25 H new ATOM 0 HG21 ILE A 80 -19.070 -2.503 -47.335 1.00 24.01 H new ATOM 0 HG22 ILE A 80 -20.012 -1.478 -48.444 1.00 24.01 H new ATOM 0 HG23 ILE A 80 -18.343 -1.938 -48.858 1.00 24.01 H new ATOM 0 HD11 ILE A 80 -16.105 -1.931 -45.267 1.00 43.25 H new ATOM 0 HD12 ILE A 80 -17.797 -1.568 -44.854 1.00 43.25 H new ATOM 0 HD13 ILE A 80 -17.427 -2.742 -46.139 1.00 43.25 H new ATOM 1213 N LYS A 81 -18.798 2.652 -46.818 1.00 23.20 N ATOM 1214 CA LYS A 81 -18.429 3.851 -46.070 1.00 11.25 C ATOM 1215 C LYS A 81 -17.324 3.559 -45.059 1.00 2.21 C ATOM 1216 O LYS A 81 -16.616 4.469 -44.630 1.00 14.32 O ATOM 1217 CB LYS A 81 -19.656 4.482 -45.389 1.00 0.11 C ATOM 1218 CG LYS A 81 -20.462 5.377 -46.328 1.00 41.11 C ATOM 1219 CD LYS A 81 -19.598 6.516 -46.868 1.00 62.14 C ATOM 1220 CE LYS A 81 -20.308 7.339 -47.933 1.00 73.31 C ATOM 1221 NZ LYS A 81 -19.429 8.421 -48.455 1.00 30.33 N ATOM 0 H LYS A 81 -19.773 2.371 -46.711 1.00 23.20 H new ATOM 0 HA LYS A 81 -18.037 4.576 -46.784 1.00 11.25 H new ATOM 0 HB2 LYS A 81 -20.301 3.690 -45.007 1.00 0.11 H new ATOM 0 HB3 LYS A 81 -19.328 5.067 -44.530 1.00 0.11 H new ATOM 0 HG2 LYS A 81 -20.851 4.785 -47.157 1.00 41.11 H new ATOM 0 HG3 LYS A 81 -21.322 5.787 -45.798 1.00 41.11 H new ATOM 0 HD2 LYS A 81 -19.308 7.168 -46.044 1.00 62.14 H new ATOM 0 HD3 LYS A 81 -18.680 6.103 -47.286 1.00 62.14 H new ATOM 0 HE2 LYS A 81 -20.615 6.690 -48.753 1.00 73.31 H new ATOM 0 HE3 LYS A 81 -21.215 7.775 -47.514 1.00 73.31 H new ATOM 0 HZ1 LYS A 81 -19.976 9.037 -49.090 1.00 30.33 H new ATOM 0 HZ2 LYS A 81 -19.061 8.983 -47.661 1.00 30.33 H new ATOM 0 HZ3 LYS A 81 -18.635 8.001 -48.979 1.00 30.33 H new ATOM 1235 N GLY A 82 -17.174 2.291 -44.690 1.00 34.43 N ATOM 1236 CA GLY A 82 -16.044 1.888 -43.874 1.00 31.53 C ATOM 1237 C GLY A 82 -14.720 2.204 -44.556 1.00 11.44 C ATOM 1238 O GLY A 82 -13.826 2.799 -43.953 1.00 11.05 O ATOM 0 H GLY A 82 -17.813 1.537 -44.941 1.00 34.43 H new ATOM 0 HA2 GLY A 82 -16.089 2.398 -42.912 1.00 31.53 H new ATOM 0 HA3 GLY A 82 -16.104 0.819 -43.671 1.00 31.53 H new ATOM 1242 N TRP A 83 -14.612 1.830 -45.831 1.00 20.04 N ATOM 1243 CA TRP A 83 -13.393 2.063 -46.603 1.00 54.32 C ATOM 1244 C TRP A 83 -13.340 3.510 -47.091 1.00 71.34 C ATOM 1245 O TRP A 83 -12.262 4.071 -47.267 1.00 52.20 O ATOM 1246 CB TRP A 83 -13.305 1.087 -47.786 1.00 1.15 C ATOM 1247 CG TRP A 83 -13.210 -0.353 -47.364 1.00 60.24 C ATOM 1248 CD1 TRP A 83 -12.491 -0.853 -46.313 1.00 62.11 C ATOM 1249 CD2 TRP A 83 -13.836 -1.482 -47.989 1.00 23.23 C ATOM 1250 NE1 TRP A 83 -12.643 -2.216 -46.242 1.00 5.04 N ATOM 1251 CE2 TRP A 83 -13.459 -2.627 -47.259 1.00 4.34 C ATOM 1252 CE3 TRP A 83 -14.680 -1.638 -49.092 1.00 42.12 C ATOM 1253 CZ2 TRP A 83 -13.898 -3.903 -47.596 1.00 13.44 C ATOM 1254 CZ3 TRP A 83 -15.114 -2.907 -49.426 1.00 3.14 C ATOM 1255 CH2 TRP A 83 -14.724 -4.026 -48.678 1.00 54.32 C ATOM 0 H TRP A 83 -15.355 1.364 -46.351 1.00 20.04 H new ATOM 0 HA TRP A 83 -12.535 1.887 -45.954 1.00 54.32 H new ATOM 0 HB2 TRP A 83 -14.182 1.215 -48.420 1.00 1.15 H new ATOM 0 HB3 TRP A 83 -12.435 1.339 -48.392 1.00 1.15 H new ATOM 0 HD1 TRP A 83 -11.891 -0.262 -45.637 1.00 62.11 H new ATOM 0 HE1 TRP A 83 -12.216 -2.824 -45.543 1.00 5.04 H new ATOM 0 HE3 TRP A 83 -14.988 -0.782 -49.673 1.00 42.12 H new ATOM 0 HZ2 TRP A 83 -13.597 -4.767 -47.022 1.00 13.44 H new ATOM 0 HZ3 TRP A 83 -15.765 -3.038 -50.278 1.00 3.14 H new ATOM 0 HH2 TRP A 83 -15.083 -5.004 -48.962 1.00 54.32 H new ATOM 1266 N ASP A 84 -14.514 4.101 -47.304 1.00 72.43 N ATOM 1267 CA ASP A 84 -14.625 5.519 -47.670 1.00 32.24 C ATOM 1268 C ASP A 84 -13.967 6.386 -46.592 1.00 32.32 C ATOM 1269 O ASP A 84 -13.043 7.164 -46.860 1.00 11.55 O ATOM 1270 CB ASP A 84 -16.116 5.882 -47.826 1.00 51.14 C ATOM 1271 CG ASP A 84 -16.389 7.359 -48.098 1.00 24.20 C ATOM 1272 OD1 ASP A 84 -16.349 8.162 -47.142 1.00 41.55 O ATOM 1273 OD2 ASP A 84 -16.714 7.710 -49.255 1.00 3.24 O ATOM 0 H ASP A 84 -15.410 3.619 -47.230 1.00 72.43 H new ATOM 0 HA ASP A 84 -14.113 5.701 -48.615 1.00 32.24 H new ATOM 0 HB2 ASP A 84 -16.536 5.293 -48.642 1.00 51.14 H new ATOM 0 HB3 ASP A 84 -16.644 5.590 -46.918 1.00 51.14 H new ATOM 1278 N GLN A 85 -14.417 6.201 -45.356 1.00 53.44 N ATOM 1279 CA GLN A 85 -13.836 6.893 -44.214 1.00 73.31 C ATOM 1280 C GLN A 85 -12.414 6.394 -43.974 1.00 50.41 C ATOM 1281 O GLN A 85 -11.526 7.164 -43.599 1.00 43.23 O ATOM 1282 CB GLN A 85 -14.702 6.674 -42.968 1.00 11.22 C ATOM 1283 CG GLN A 85 -16.109 7.253 -43.094 1.00 25.14 C ATOM 1284 CD GLN A 85 -17.012 6.877 -41.933 1.00 22.14 C ATOM 1285 OE1 GLN A 85 -16.551 6.657 -40.810 1.00 20.15 O ATOM 1286 NE2 GLN A 85 -18.307 6.814 -42.189 1.00 2.41 N ATOM 0 H GLN A 85 -15.186 5.574 -45.120 1.00 53.44 H new ATOM 0 HA GLN A 85 -13.800 7.962 -44.424 1.00 73.31 H new ATOM 0 HB2 GLN A 85 -14.774 5.605 -42.769 1.00 11.22 H new ATOM 0 HB3 GLN A 85 -14.208 7.126 -42.108 1.00 11.22 H new ATOM 0 HG2 GLN A 85 -16.044 8.339 -43.160 1.00 25.14 H new ATOM 0 HG3 GLN A 85 -16.558 6.904 -44.024 1.00 25.14 H new ATOM 0 HE21 GLN A 85 -18.650 7.003 -43.131 1.00 2.41 H new ATOM 0 HE22 GLN A 85 -18.963 6.577 -41.445 1.00 2.41 H new ATOM 1295 N GLY A 86 -12.207 5.099 -44.210 1.00 70.40 N ATOM 1296 CA GLY A 86 -10.887 4.504 -44.070 1.00 62.34 C ATOM 1297 C GLY A 86 -9.832 5.236 -44.882 1.00 13.43 C ATOM 1298 O GLY A 86 -8.772 5.587 -44.361 1.00 1.43 O ATOM 0 H GLY A 86 -12.937 4.447 -44.498 1.00 70.40 H new ATOM 0 HA2 GLY A 86 -10.600 4.508 -43.019 1.00 62.34 H new ATOM 0 HA3 GLY A 86 -10.926 3.462 -44.386 1.00 62.34 H new ATOM 1302 N VAL A 87 -10.125 5.481 -46.155 1.00 54.13 N ATOM 1303 CA VAL A 87 -9.201 6.200 -47.022 1.00 50.24 C ATOM 1304 C VAL A 87 -9.219 7.694 -46.693 1.00 54.40 C ATOM 1305 O VAL A 87 -8.196 8.373 -46.783 1.00 10.11 O ATOM 1306 CB VAL A 87 -9.516 5.976 -48.528 1.00 55.44 C ATOM 1307 CG1 VAL A 87 -10.903 6.500 -48.896 1.00 34.31 C ATOM 1308 CG2 VAL A 87 -8.442 6.616 -49.405 1.00 62.31 C ATOM 0 H VAL A 87 -10.993 5.193 -46.607 1.00 54.13 H new ATOM 0 HA VAL A 87 -8.204 5.802 -46.836 1.00 50.24 H new ATOM 0 HB VAL A 87 -9.514 4.901 -48.710 1.00 55.44 H new ATOM 0 HG11 VAL A 87 -11.088 6.326 -49.956 1.00 34.31 H new ATOM 0 HG12 VAL A 87 -11.657 5.979 -48.306 1.00 34.31 H new ATOM 0 HG13 VAL A 87 -10.955 7.569 -48.689 1.00 34.31 H new ATOM 0 HG21 VAL A 87 -8.682 6.448 -50.455 1.00 62.31 H new ATOM 0 HG22 VAL A 87 -8.403 7.688 -49.209 1.00 62.31 H new ATOM 0 HG23 VAL A 87 -7.474 6.170 -49.178 1.00 62.31 H new ATOM 1318 N ALA A 88 -10.382 8.194 -46.282 1.00 43.42 N ATOM 1319 CA ALA A 88 -10.526 9.603 -45.920 1.00 63.54 C ATOM 1320 C ALA A 88 -9.678 9.972 -44.693 1.00 61.41 C ATOM 1321 O ALA A 88 -9.224 11.113 -44.569 1.00 62.12 O ATOM 1322 CB ALA A 88 -11.991 9.941 -45.668 1.00 72.34 C ATOM 0 H ALA A 88 -11.237 7.646 -46.191 1.00 43.42 H new ATOM 0 HA ALA A 88 -10.161 10.192 -46.761 1.00 63.54 H new ATOM 0 HB1 ALA A 88 -12.081 10.994 -45.400 1.00 72.34 H new ATOM 0 HB2 ALA A 88 -12.570 9.746 -46.571 1.00 72.34 H new ATOM 0 HB3 ALA A 88 -12.372 9.325 -44.853 1.00 72.34 H new ATOM 1328 N THR A 89 -9.461 9.011 -43.795 1.00 71.10 N ATOM 1329 CA THR A 89 -8.739 9.273 -42.548 1.00 21.14 C ATOM 1330 C THR A 89 -7.225 9.043 -42.696 1.00 72.32 C ATOM 1331 O THR A 89 -6.442 9.479 -41.848 1.00 61.43 O ATOM 1332 CB THR A 89 -9.289 8.403 -41.382 1.00 10.23 C ATOM 1333 OG1 THR A 89 -8.711 8.810 -40.131 1.00 70.41 O ATOM 1334 CG2 THR A 89 -9.004 6.922 -41.609 1.00 23.35 C ATOM 0 H THR A 89 -9.773 8.046 -43.906 1.00 71.10 H new ATOM 0 HA THR A 89 -8.902 10.325 -42.313 1.00 21.14 H new ATOM 0 HB THR A 89 -10.369 8.550 -41.350 1.00 10.23 H new ATOM 0 HG1 THR A 89 -7.805 9.150 -40.285 1.00 70.41 H new ATOM 0 HG21 THR A 89 -9.402 6.343 -40.776 1.00 23.35 H new ATOM 0 HG22 THR A 89 -9.479 6.598 -42.535 1.00 23.35 H new ATOM 0 HG23 THR A 89 -7.928 6.765 -41.679 1.00 23.35 H new ATOM 1342 N MET A 90 -6.811 8.370 -43.771 1.00 23.21 N ATOM 1343 CA MET A 90 -5.388 8.075 -43.986 1.00 52.35 C ATOM 1344 C MET A 90 -4.735 9.147 -44.861 1.00 34.44 C ATOM 1345 O MET A 90 -5.391 10.105 -45.278 1.00 64.34 O ATOM 1346 CB MET A 90 -5.205 6.693 -44.628 1.00 2.44 C ATOM 1347 CG MET A 90 -5.728 6.596 -46.052 1.00 20.52 C ATOM 1348 SD MET A 90 -5.476 4.963 -46.770 1.00 33.02 S ATOM 1349 CE MET A 90 -6.376 3.943 -45.614 1.00 71.33 C ATOM 0 H MET A 90 -7.432 8.021 -44.501 1.00 23.21 H new ATOM 0 HA MET A 90 -4.900 8.074 -43.011 1.00 52.35 H new ATOM 0 HB2 MET A 90 -4.145 6.440 -44.624 1.00 2.44 H new ATOM 0 HB3 MET A 90 -5.713 5.949 -44.014 1.00 2.44 H new ATOM 0 HG2 MET A 90 -6.792 6.833 -46.062 1.00 20.52 H new ATOM 0 HG3 MET A 90 -5.229 7.342 -46.670 1.00 20.52 H new ATOM 0 HE1 MET A 90 -5.675 3.328 -45.049 1.00 71.33 H new ATOM 0 HE2 MET A 90 -6.936 4.578 -44.928 1.00 71.33 H new ATOM 0 HE3 MET A 90 -7.067 3.299 -46.158 1.00 71.33 H new ATOM 1359 N THR A 91 -3.439 8.980 -45.128 1.00 54.53 N ATOM 1360 CA THR A 91 -2.681 9.924 -45.946 1.00 60.53 C ATOM 1361 C THR A 91 -1.730 9.191 -46.903 1.00 4.54 C ATOM 1362 O THR A 91 -1.674 7.959 -46.906 1.00 62.15 O ATOM 1363 CB THR A 91 -1.893 10.918 -45.055 1.00 2.34 C ATOM 1364 OG1 THR A 91 -1.208 10.214 -44.007 1.00 75.53 O ATOM 1365 CG2 THR A 91 -2.820 11.966 -44.443 1.00 54.53 C ATOM 0 H THR A 91 -2.890 8.192 -44.785 1.00 54.53 H new ATOM 0 HA THR A 91 -3.395 10.489 -46.545 1.00 60.53 H new ATOM 0 HB THR A 91 -1.165 11.425 -45.688 1.00 2.34 H new ATOM 0 HG1 THR A 91 -1.838 9.622 -43.545 1.00 75.53 H new ATOM 0 HG21 THR A 91 -2.239 12.649 -43.823 1.00 54.53 H new ATOM 0 HG22 THR A 91 -3.311 12.527 -45.239 1.00 54.53 H new ATOM 0 HG23 THR A 91 -3.573 11.472 -43.830 1.00 54.53 H new ATOM 1373 N LEU A 92 -1.000 9.957 -47.717 1.00 74.01 N ATOM 1374 CA LEU A 92 -0.108 9.406 -48.740 1.00 25.41 C ATOM 1375 C LEU A 92 0.952 8.498 -48.103 1.00 32.24 C ATOM 1376 O LEU A 92 1.687 8.917 -47.196 1.00 31.23 O ATOM 1377 CB LEU A 92 0.561 10.562 -49.520 1.00 14.43 C ATOM 1378 CG LEU A 92 1.091 10.243 -50.935 1.00 74.12 C ATOM 1379 CD1 LEU A 92 2.214 9.210 -50.908 1.00 1.01 C ATOM 1380 CD2 LEU A 92 -0.046 9.784 -51.843 1.00 24.41 C ATOM 0 H LEU A 92 -1.011 10.976 -47.686 1.00 74.01 H new ATOM 0 HA LEU A 92 -0.693 8.801 -49.433 1.00 25.41 H new ATOM 0 HB2 LEU A 92 -0.160 11.375 -49.604 1.00 14.43 H new ATOM 0 HB3 LEU A 92 1.393 10.935 -48.923 1.00 14.43 H new ATOM 0 HG LEU A 92 1.512 11.164 -51.339 1.00 74.12 H new ATOM 0 HD11 LEU A 92 2.555 9.017 -51.925 1.00 1.01 H new ATOM 0 HD12 LEU A 92 3.044 9.590 -50.313 1.00 1.01 H new ATOM 0 HD13 LEU A 92 1.846 8.284 -50.467 1.00 1.01 H new ATOM 0 HD21 LEU A 92 0.347 9.564 -52.836 1.00 24.41 H new ATOM 0 HD22 LEU A 92 -0.504 8.887 -51.427 1.00 24.41 H new ATOM 0 HD23 LEU A 92 -0.794 10.573 -51.916 1.00 24.41 H new ATOM 1392 N GLY A 93 1.013 7.254 -48.586 1.00 34.21 N ATOM 1393 CA GLY A 93 2.016 6.306 -48.134 1.00 5.55 C ATOM 1394 C GLY A 93 1.744 5.803 -46.734 1.00 72.25 C ATOM 1395 O GLY A 93 2.670 5.599 -45.949 1.00 64.11 O ATOM 0 H GLY A 93 0.375 6.886 -49.291 1.00 34.21 H new ATOM 0 HA2 GLY A 93 2.049 5.460 -48.821 1.00 5.55 H new ATOM 0 HA3 GLY A 93 2.998 6.778 -48.163 1.00 5.55 H new ATOM 1399 N GLU A 94 0.469 5.598 -46.423 1.00 71.34 N ATOM 1400 CA GLU A 94 0.059 5.177 -45.090 1.00 13.03 C ATOM 1401 C GLU A 94 -0.759 3.888 -45.151 1.00 35.11 C ATOM 1402 O GLU A 94 -1.739 3.795 -45.897 1.00 11.33 O ATOM 1403 CB GLU A 94 -0.736 6.307 -44.418 1.00 33.44 C ATOM 1404 CG GLU A 94 -1.093 6.050 -42.959 1.00 42.11 C ATOM 1405 CD GLU A 94 -1.358 7.338 -42.196 1.00 1.35 C ATOM 1406 OE1 GLU A 94 -2.375 8.006 -42.473 1.00 1.51 O ATOM 1407 OE2 GLU A 94 -0.529 7.705 -41.331 1.00 22.02 O ATOM 0 H GLU A 94 -0.302 5.718 -47.080 1.00 71.34 H new ATOM 0 HA GLU A 94 0.947 4.969 -44.494 1.00 13.03 H new ATOM 0 HB2 GLU A 94 -0.156 7.228 -44.480 1.00 33.44 H new ATOM 0 HB3 GLU A 94 -1.655 6.471 -44.980 1.00 33.44 H new ATOM 0 HG2 GLU A 94 -1.976 5.413 -42.910 1.00 42.11 H new ATOM 0 HG3 GLU A 94 -0.280 5.506 -42.478 1.00 42.11 H new ATOM 1414 N LYS A 95 -0.330 2.891 -44.376 1.00 63.35 N ATOM 1415 CA LYS A 95 -1.040 1.619 -44.261 1.00 74.54 C ATOM 1416 C LYS A 95 -1.560 1.452 -42.838 1.00 2.34 C ATOM 1417 O LYS A 95 -0.779 1.355 -41.884 1.00 24.43 O ATOM 1418 CB LYS A 95 -0.124 0.435 -44.625 1.00 62.30 C ATOM 1419 CG LYS A 95 -0.795 -0.933 -44.456 1.00 64.33 C ATOM 1420 CD LYS A 95 0.179 -2.091 -44.669 1.00 65.41 C ATOM 1421 CE LYS A 95 0.668 -2.185 -46.111 1.00 1.24 C ATOM 1422 NZ LYS A 95 -0.433 -2.509 -47.061 1.00 21.52 N ATOM 0 H LYS A 95 0.518 2.943 -43.812 1.00 63.35 H new ATOM 0 HA LYS A 95 -1.876 1.628 -44.960 1.00 74.54 H new ATOM 0 HB2 LYS A 95 0.204 0.544 -45.659 1.00 62.30 H new ATOM 0 HB3 LYS A 95 0.769 0.472 -44.001 1.00 62.30 H new ATOM 0 HG2 LYS A 95 -1.225 -1.003 -43.457 1.00 64.33 H new ATOM 0 HG3 LYS A 95 -1.619 -1.020 -45.164 1.00 64.33 H new ATOM 0 HD2 LYS A 95 1.035 -1.968 -44.006 1.00 65.41 H new ATOM 0 HD3 LYS A 95 -0.307 -3.026 -44.392 1.00 65.41 H new ATOM 0 HE2 LYS A 95 1.127 -1.239 -46.399 1.00 1.24 H new ATOM 0 HE3 LYS A 95 1.442 -2.949 -46.181 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 -0.218 -2.101 -47.993 1.00 21.52 H new ATOM 0 HZ2 LYS A 95 -0.525 -3.541 -47.147 1.00 21.52 H new ATOM 0 HZ3 LYS A 95 -1.326 -2.111 -46.706 1.00 21.52 H new ATOM 1436 N ALA A 96 -2.877 1.430 -42.694 1.00 20.50 N ATOM 1437 CA ALA A 96 -3.514 1.295 -41.392 1.00 55.24 C ATOM 1438 C ALA A 96 -4.253 -0.033 -41.291 1.00 22.35 C ATOM 1439 O ALA A 96 -4.804 -0.523 -42.278 1.00 52.31 O ATOM 1440 CB ALA A 96 -4.474 2.455 -41.145 1.00 14.21 C ATOM 0 H ALA A 96 -3.532 1.505 -43.473 1.00 20.50 H new ATOM 0 HA ALA A 96 -2.737 1.317 -40.627 1.00 55.24 H new ATOM 0 HB1 ALA A 96 -4.942 2.338 -40.167 1.00 14.21 H new ATOM 0 HB2 ALA A 96 -3.924 3.395 -41.174 1.00 14.21 H new ATOM 0 HB3 ALA A 96 -5.244 2.461 -41.917 1.00 14.21 H new ATOM 1446 N LEU A 97 -4.254 -0.604 -40.098 1.00 62.33 N ATOM 1447 CA LEU A 97 -4.986 -1.830 -39.823 1.00 4.54 C ATOM 1448 C LEU A 97 -6.383 -1.449 -39.347 1.00 23.15 C ATOM 1449 O LEU A 97 -6.551 -0.972 -38.223 1.00 2.53 O ATOM 1450 CB LEU A 97 -4.221 -2.661 -38.769 1.00 62.35 C ATOM 1451 CG LEU A 97 -4.834 -4.024 -38.374 1.00 23.42 C ATOM 1452 CD1 LEU A 97 -3.750 -4.968 -37.848 1.00 52.33 C ATOM 1453 CD2 LEU A 97 -5.930 -3.857 -37.319 1.00 12.41 C ATOM 0 H LEU A 97 -3.749 -0.232 -39.294 1.00 62.33 H new ATOM 0 HA LEU A 97 -5.077 -2.446 -40.717 1.00 4.54 H new ATOM 0 HB2 LEU A 97 -3.213 -2.838 -39.143 1.00 62.35 H new ATOM 0 HB3 LEU A 97 -4.125 -2.058 -37.866 1.00 62.35 H new ATOM 0 HG LEU A 97 -5.282 -4.455 -39.270 1.00 23.42 H new ATOM 0 HD11 LEU A 97 -4.200 -5.922 -37.575 1.00 52.33 H new ATOM 0 HD12 LEU A 97 -3.000 -5.129 -38.623 1.00 52.33 H new ATOM 0 HD13 LEU A 97 -3.277 -4.526 -36.971 1.00 52.33 H new ATOM 0 HD21 LEU A 97 -6.341 -4.834 -37.063 1.00 12.41 H new ATOM 0 HD22 LEU A 97 -5.508 -3.395 -36.426 1.00 12.41 H new ATOM 0 HD23 LEU A 97 -6.723 -3.223 -37.715 1.00 12.41 H new ATOM 1465 N PHE A 98 -7.370 -1.627 -40.216 1.00 33.43 N ATOM 1466 CA PHE A 98 -8.728 -1.163 -39.954 1.00 22.33 C ATOM 1467 C PHE A 98 -9.672 -2.352 -39.770 1.00 65.01 C ATOM 1468 O PHE A 98 -9.731 -3.246 -40.618 1.00 52.24 O ATOM 1469 CB PHE A 98 -9.201 -0.276 -41.119 1.00 14.23 C ATOM 1470 CG PHE A 98 -10.421 0.564 -40.812 1.00 54.22 C ATOM 1471 CD1 PHE A 98 -11.703 0.063 -40.999 1.00 1.45 C ATOM 1472 CD2 PHE A 98 -10.281 1.865 -40.343 1.00 54.43 C ATOM 1473 CE1 PHE A 98 -12.813 0.837 -40.723 1.00 61.40 C ATOM 1474 CE2 PHE A 98 -11.391 2.642 -40.068 1.00 53.50 C ATOM 1475 CZ PHE A 98 -12.658 2.127 -40.258 1.00 43.13 C ATOM 0 H PHE A 98 -7.254 -2.093 -41.116 1.00 33.43 H new ATOM 0 HA PHE A 98 -8.735 -0.578 -39.034 1.00 22.33 H new ATOM 0 HB2 PHE A 98 -8.385 0.385 -41.411 1.00 14.23 H new ATOM 0 HB3 PHE A 98 -9.419 -0.911 -41.977 1.00 14.23 H new ATOM 0 HD1 PHE A 98 -11.833 -0.945 -41.365 1.00 1.45 H new ATOM 0 HD2 PHE A 98 -9.293 2.274 -40.192 1.00 54.43 H new ATOM 0 HE1 PHE A 98 -13.803 0.432 -40.871 1.00 61.40 H new ATOM 0 HE2 PHE A 98 -11.267 3.651 -39.705 1.00 53.50 H new ATOM 0 HZ PHE A 98 -13.526 2.733 -40.043 1.00 43.13 H new ATOM 1485 N THR A 99 -10.393 -2.367 -38.657 1.00 0.52 N ATOM 1486 CA THR A 99 -11.358 -3.424 -38.378 1.00 41.40 C ATOM 1487 C THR A 99 -12.709 -3.109 -39.032 1.00 32.20 C ATOM 1488 O THR A 99 -13.331 -2.092 -38.719 1.00 23.33 O ATOM 1489 CB THR A 99 -11.554 -3.597 -36.857 1.00 71.14 C ATOM 1490 OG1 THR A 99 -10.279 -3.610 -36.200 1.00 32.31 O ATOM 1491 CG2 THR A 99 -12.305 -4.887 -36.535 1.00 45.34 C ATOM 0 H THR A 99 -10.328 -1.656 -37.929 1.00 0.52 H new ATOM 0 HA THR A 99 -10.966 -4.352 -38.795 1.00 41.40 H new ATOM 0 HB THR A 99 -12.148 -2.756 -36.498 1.00 71.14 H new ATOM 0 HG1 THR A 99 -9.863 -2.726 -36.276 1.00 32.31 H new ATOM 0 HG21 THR A 99 -12.426 -4.978 -35.456 1.00 45.34 H new ATOM 0 HG22 THR A 99 -13.286 -4.865 -37.010 1.00 45.34 H new ATOM 0 HG23 THR A 99 -11.740 -5.740 -36.910 1.00 45.34 H new ATOM 1499 N ILE A 100 -13.146 -3.968 -39.950 1.00 21.32 N ATOM 1500 CA ILE A 100 -14.434 -3.803 -40.618 1.00 55.40 C ATOM 1501 C ILE A 100 -15.493 -4.699 -39.965 1.00 14.24 C ATOM 1502 O ILE A 100 -15.440 -5.930 -40.093 1.00 1.33 O ATOM 1503 CB ILE A 100 -14.335 -4.128 -42.135 1.00 12.11 C ATOM 1504 CG1 ILE A 100 -13.458 -3.086 -42.858 1.00 60.11 C ATOM 1505 CG2 ILE A 100 -15.727 -4.195 -42.774 1.00 11.45 C ATOM 1506 CD1 ILE A 100 -14.062 -1.693 -42.899 1.00 2.12 C ATOM 0 H ILE A 100 -12.623 -4.791 -40.250 1.00 21.32 H new ATOM 0 HA ILE A 100 -14.728 -2.759 -40.511 1.00 55.40 H new ATOM 0 HB ILE A 100 -13.866 -5.106 -42.240 1.00 12.11 H new ATOM 0 HG12 ILE A 100 -12.488 -3.036 -42.363 1.00 60.11 H new ATOM 0 HG13 ILE A 100 -13.278 -3.423 -43.879 1.00 60.11 H new ATOM 0 HG21 ILE A 100 -15.630 -4.424 -43.835 1.00 11.45 H new ATOM 0 HG22 ILE A 100 -16.314 -4.974 -42.287 1.00 11.45 H new ATOM 0 HG23 ILE A 100 -16.229 -3.235 -42.654 1.00 11.45 H new ATOM 0 HD11 ILE A 100 -13.385 -1.018 -43.424 1.00 2.12 H new ATOM 0 HD12 ILE A 100 -15.018 -1.726 -43.421 1.00 2.12 H new ATOM 0 HD13 ILE A 100 -14.216 -1.333 -41.882 1.00 2.12 H new ATOM 1518 N PRO A 101 -16.450 -4.094 -39.227 1.00 5.44 N ATOM 1519 CA PRO A 101 -17.570 -4.818 -38.621 1.00 42.13 C ATOM 1520 C PRO A 101 -18.564 -5.289 -39.681 1.00 14.34 C ATOM 1521 O PRO A 101 -18.853 -4.561 -40.635 1.00 14.05 O ATOM 1522 CB PRO A 101 -18.226 -3.784 -37.681 1.00 51.24 C ATOM 1523 CG PRO A 101 -17.271 -2.635 -37.620 1.00 0.42 C ATOM 1524 CD PRO A 101 -16.510 -2.657 -38.916 1.00 24.24 C ATOM 0 HA PRO A 101 -17.243 -5.716 -38.097 1.00 42.13 H new ATOM 0 HB2 PRO A 101 -19.197 -3.467 -38.063 1.00 51.24 H new ATOM 0 HB3 PRO A 101 -18.395 -4.206 -36.690 1.00 51.24 H new ATOM 0 HG2 PRO A 101 -17.803 -1.692 -37.496 1.00 0.42 H new ATOM 0 HG3 PRO A 101 -16.596 -2.734 -36.770 1.00 0.42 H new ATOM 0 HD2 PRO A 101 -17.022 -2.094 -39.697 1.00 24.24 H new ATOM 0 HD3 PRO A 101 -15.516 -2.223 -38.810 1.00 24.24 H new ATOM 1532 N TYR A 102 -19.095 -6.495 -39.501 1.00 62.24 N ATOM 1533 CA TYR A 102 -20.003 -7.094 -40.477 1.00 42.32 C ATOM 1534 C TYR A 102 -21.196 -6.183 -40.779 1.00 55.45 C ATOM 1535 O TYR A 102 -21.739 -6.202 -41.881 1.00 63.25 O ATOM 1536 CB TYR A 102 -20.494 -8.460 -39.982 1.00 22.34 C ATOM 1537 CG TYR A 102 -21.363 -8.413 -38.732 1.00 74.23 C ATOM 1538 CD1 TYR A 102 -22.743 -8.264 -38.831 1.00 52.43 C ATOM 1539 CD2 TYR A 102 -20.810 -8.537 -37.459 1.00 34.34 C ATOM 1540 CE1 TYR A 102 -23.544 -8.237 -37.708 1.00 11.43 C ATOM 1541 CE2 TYR A 102 -21.610 -8.513 -36.329 1.00 44.51 C ATOM 1542 CZ TYR A 102 -22.976 -8.363 -36.460 1.00 3.53 C ATOM 1543 OH TYR A 102 -23.774 -8.342 -35.341 1.00 60.43 O ATOM 0 H TYR A 102 -18.912 -7.079 -38.685 1.00 62.24 H new ATOM 0 HA TYR A 102 -19.445 -7.227 -41.404 1.00 42.32 H new ATOM 0 HB2 TYR A 102 -21.059 -8.939 -40.782 1.00 22.34 H new ATOM 0 HB3 TYR A 102 -19.628 -9.091 -39.782 1.00 22.34 H new ATOM 0 HD1 TYR A 102 -23.196 -8.168 -39.807 1.00 52.43 H new ATOM 0 HD2 TYR A 102 -19.742 -8.654 -37.352 1.00 34.34 H new ATOM 0 HE1 TYR A 102 -24.613 -8.117 -37.807 1.00 11.43 H new ATOM 0 HE2 TYR A 102 -21.167 -8.611 -35.349 1.00 44.51 H new ATOM 0 HH TYR A 102 -23.275 -7.956 -34.591 1.00 60.43 H new ATOM 1553 N GLN A 103 -21.584 -5.381 -39.791 1.00 54.01 N ATOM 1554 CA GLN A 103 -22.740 -4.491 -39.917 1.00 73.14 C ATOM 1555 C GLN A 103 -22.549 -3.475 -41.042 1.00 73.11 C ATOM 1556 O GLN A 103 -23.517 -3.049 -41.676 1.00 64.20 O ATOM 1557 CB GLN A 103 -22.981 -3.756 -38.589 1.00 20.21 C ATOM 1558 CG GLN A 103 -23.318 -4.681 -37.425 1.00 52.32 C ATOM 1559 CD GLN A 103 -23.410 -3.946 -36.098 1.00 12.35 C ATOM 1560 OE1 GLN A 103 -22.424 -3.818 -35.376 1.00 44.32 O ATOM 1561 NE2 GLN A 103 -24.591 -3.446 -35.772 1.00 41.41 N ATOM 0 H GLN A 103 -21.113 -5.328 -38.888 1.00 54.01 H new ATOM 0 HA GLN A 103 -23.607 -5.104 -40.162 1.00 73.14 H new ATOM 0 HB2 GLN A 103 -22.091 -3.180 -38.337 1.00 20.21 H new ATOM 0 HB3 GLN A 103 -23.795 -3.043 -38.722 1.00 20.21 H new ATOM 0 HG2 GLN A 103 -24.266 -5.180 -37.626 1.00 52.32 H new ATOM 0 HG3 GLN A 103 -22.558 -5.459 -37.353 1.00 52.32 H new ATOM 0 HE21 GLN A 103 -25.388 -3.572 -36.396 1.00 41.41 H new ATOM 0 HE22 GLN A 103 -24.704 -2.935 -34.897 1.00 41.41 H new ATOM 1570 N LEU A 104 -21.299 -3.105 -41.296 1.00 62.14 N ATOM 1571 CA LEU A 104 -20.983 -2.038 -42.250 1.00 32.30 C ATOM 1572 C LEU A 104 -20.554 -2.598 -43.605 1.00 63.52 C ATOM 1573 O LEU A 104 -20.108 -1.844 -44.475 1.00 31.32 O ATOM 1574 CB LEU A 104 -19.871 -1.141 -41.686 1.00 72.14 C ATOM 1575 CG LEU A 104 -20.165 -0.511 -40.313 1.00 20.21 C ATOM 1576 CD1 LEU A 104 -18.990 0.347 -39.845 1.00 1.30 C ATOM 1577 CD2 LEU A 104 -21.453 0.312 -40.358 1.00 71.42 C ATOM 0 H LEU A 104 -20.482 -3.527 -40.855 1.00 62.14 H new ATOM 0 HA LEU A 104 -21.889 -1.452 -42.401 1.00 32.30 H new ATOM 0 HB2 LEU A 104 -18.957 -1.729 -41.609 1.00 72.14 H new ATOM 0 HB3 LEU A 104 -19.676 -0.341 -42.400 1.00 72.14 H new ATOM 0 HG LEU A 104 -20.302 -1.318 -39.593 1.00 20.21 H new ATOM 0 HD11 LEU A 104 -19.221 0.782 -38.873 1.00 1.30 H new ATOM 0 HD12 LEU A 104 -18.097 -0.273 -39.762 1.00 1.30 H new ATOM 0 HD13 LEU A 104 -18.812 1.145 -40.566 1.00 1.30 H new ATOM 0 HD21 LEU A 104 -21.641 0.748 -39.377 1.00 71.42 H new ATOM 0 HD22 LEU A 104 -21.350 1.108 -41.095 1.00 71.42 H new ATOM 0 HD23 LEU A 104 -22.287 -0.333 -40.634 1.00 71.42 H new ATOM 1589 N ALA A 105 -20.702 -3.906 -43.793 1.00 62.01 N ATOM 1590 CA ALA A 105 -20.257 -4.557 -45.024 1.00 15.02 C ATOM 1591 C ALA A 105 -21.093 -5.794 -45.341 1.00 14.10 C ATOM 1592 O ALA A 105 -21.995 -6.161 -44.591 1.00 75.53 O ATOM 1593 CB ALA A 105 -18.782 -4.933 -44.913 1.00 53.05 C ATOM 0 H ALA A 105 -21.125 -4.536 -43.111 1.00 62.01 H new ATOM 0 HA ALA A 105 -20.389 -3.849 -45.842 1.00 15.02 H new ATOM 0 HB1 ALA A 105 -18.460 -5.417 -45.835 1.00 53.05 H new ATOM 0 HB2 ALA A 105 -18.189 -4.034 -44.749 1.00 53.05 H new ATOM 0 HB3 ALA A 105 -18.643 -5.617 -44.076 1.00 53.05 H new ATOM 1599 N TYR A 106 -20.766 -6.435 -46.461 1.00 54.43 N ATOM 1600 CA TYR A 106 -21.441 -7.658 -46.896 1.00 22.33 C ATOM 1601 C TYR A 106 -21.024 -8.859 -46.041 1.00 52.22 C ATOM 1602 O TYR A 106 -21.530 -9.970 -46.224 1.00 2.43 O ATOM 1603 CB TYR A 106 -21.151 -7.928 -48.384 1.00 62.33 C ATOM 1604 CG TYR A 106 -19.677 -7.838 -48.757 1.00 72.41 C ATOM 1605 CD1 TYR A 106 -18.841 -8.947 -48.665 1.00 15.41 C ATOM 1606 CD2 TYR A 106 -19.122 -6.636 -49.193 1.00 61.54 C ATOM 1607 CE1 TYR A 106 -17.501 -8.860 -48.994 1.00 43.13 C ATOM 1608 CE2 TYR A 106 -17.784 -6.545 -49.525 1.00 50.11 C ATOM 1609 CZ TYR A 106 -16.979 -7.657 -49.423 1.00 60.03 C ATOM 1610 OH TYR A 106 -15.645 -7.564 -49.749 1.00 3.12 O ATOM 0 H TYR A 106 -20.028 -6.123 -47.092 1.00 54.43 H new ATOM 0 HA TYR A 106 -22.514 -7.514 -46.767 1.00 22.33 H new ATOM 0 HB2 TYR A 106 -21.520 -8.921 -48.640 1.00 62.33 H new ATOM 0 HB3 TYR A 106 -21.712 -7.214 -48.988 1.00 62.33 H new ATOM 0 HD1 TYR A 106 -19.246 -9.891 -48.331 1.00 15.41 H new ATOM 0 HD2 TYR A 106 -19.749 -5.760 -49.273 1.00 61.54 H new ATOM 0 HE1 TYR A 106 -16.866 -9.730 -48.916 1.00 43.13 H new ATOM 0 HE2 TYR A 106 -17.372 -5.606 -49.863 1.00 50.11 H new ATOM 0 HH TYR A 106 -15.441 -6.649 -50.033 1.00 3.12 H new ATOM 1620 N GLY A 107 -20.105 -8.623 -45.102 1.00 75.14 N ATOM 1621 CA GLY A 107 -19.670 -9.668 -44.184 1.00 10.44 C ATOM 1622 C GLY A 107 -20.796 -10.139 -43.280 1.00 30.53 C ATOM 1623 O GLY A 107 -20.680 -11.170 -42.614 1.00 60.22 O ATOM 0 H GLY A 107 -19.652 -7.720 -44.961 1.00 75.14 H new ATOM 0 HA2 GLY A 107 -19.285 -10.514 -44.754 1.00 10.44 H new ATOM 0 HA3 GLY A 107 -18.848 -9.295 -43.574 1.00 10.44 H new ATOM 1627 N GLU A 108 -21.878 -9.361 -43.244 1.00 42.23 N ATOM 1628 CA GLU A 108 -23.082 -9.737 -42.512 1.00 2.53 C ATOM 1629 C GLU A 108 -23.721 -10.955 -43.177 1.00 1.12 C ATOM 1630 O GLU A 108 -24.030 -11.949 -42.515 1.00 70.21 O ATOM 1631 CB GLU A 108 -24.058 -8.544 -42.472 1.00 42.32 C ATOM 1632 CG GLU A 108 -25.288 -8.731 -41.576 1.00 4.21 C ATOM 1633 CD GLU A 108 -26.345 -9.652 -42.173 1.00 31.05 C ATOM 1634 OE1 GLU A 108 -26.724 -9.442 -43.343 1.00 42.51 O ATOM 1635 OE2 GLU A 108 -26.820 -10.573 -41.471 1.00 64.21 O ATOM 0 H GLU A 108 -21.942 -8.460 -43.718 1.00 42.23 H new ATOM 0 HA GLU A 108 -22.828 -10.001 -41.485 1.00 2.53 H new ATOM 0 HB2 GLU A 108 -23.514 -7.662 -42.134 1.00 42.32 H new ATOM 0 HB3 GLU A 108 -24.397 -8.339 -43.488 1.00 42.32 H new ATOM 0 HG2 GLU A 108 -24.969 -9.134 -40.615 1.00 4.21 H new ATOM 0 HG3 GLU A 108 -25.736 -7.757 -41.381 1.00 4.21 H new ATOM 1642 N ARG A 109 -23.891 -10.875 -44.494 1.00 41.24 N ATOM 1643 CA ARG A 109 -24.486 -11.962 -45.267 1.00 2.14 C ATOM 1644 C ARG A 109 -23.562 -13.177 -45.289 1.00 64.15 C ATOM 1645 O ARG A 109 -23.983 -14.291 -44.971 1.00 50.12 O ATOM 1646 CB ARG A 109 -24.776 -11.509 -46.705 1.00 42.44 C ATOM 1647 CG ARG A 109 -25.401 -12.596 -47.582 1.00 24.32 C ATOM 1648 CD ARG A 109 -25.581 -12.130 -49.024 1.00 60.10 C ATOM 1649 NE ARG A 109 -26.487 -10.981 -49.130 1.00 12.51 N ATOM 1650 CZ ARG A 109 -26.366 -10.009 -50.037 1.00 71.52 C ATOM 1651 NH1 ARG A 109 -25.385 -10.040 -50.930 1.00 63.01 N ATOM 1652 NH2 ARG A 109 -27.248 -9.016 -50.063 1.00 72.20 N ATOM 0 H ARG A 109 -23.623 -10.064 -45.051 1.00 41.24 H new ATOM 0 HA ARG A 109 -25.424 -12.239 -44.787 1.00 2.14 H new ATOM 0 HB2 ARG A 109 -25.445 -10.649 -46.677 1.00 42.44 H new ATOM 0 HB3 ARG A 109 -23.846 -11.175 -47.165 1.00 42.44 H new ATOM 0 HG2 ARG A 109 -24.770 -13.485 -47.564 1.00 24.32 H new ATOM 0 HG3 ARG A 109 -26.368 -12.883 -47.170 1.00 24.32 H new ATOM 0 HD2 ARG A 109 -24.610 -11.863 -49.441 1.00 60.10 H new ATOM 0 HD3 ARG A 109 -25.970 -12.953 -49.623 1.00 60.10 H new ATOM 0 HE ARG A 109 -27.260 -10.921 -48.467 1.00 12.51 H new ATOM 0 HH11 ARG A 109 -24.717 -10.810 -50.927 1.00 63.01 H new ATOM 0 HH12 ARG A 109 -25.299 -9.293 -51.620 1.00 63.01 H new ATOM 0 HH21 ARG A 109 -28.015 -8.998 -49.391 1.00 72.20 H new ATOM 0 HH22 ARG A 109 -27.158 -8.272 -50.755 1.00 72.20 H new ATOM 1666 N GLY A 110 -22.304 -12.952 -45.667 1.00 51.44 N ATOM 1667 CA GLY A 110 -21.350 -14.045 -45.795 1.00 74.31 C ATOM 1668 C GLY A 110 -21.731 -15.004 -46.911 1.00 44.44 C ATOM 1669 O GLY A 110 -22.808 -14.882 -47.497 1.00 52.23 O ATOM 0 H GLY A 110 -21.927 -12.030 -45.887 1.00 51.44 H new ATOM 0 HA2 GLY A 110 -20.357 -13.639 -45.989 1.00 74.31 H new ATOM 0 HA3 GLY A 110 -21.293 -14.589 -44.852 1.00 74.31 H new ATOM 1673 N TYR A 111 -20.845 -15.950 -47.218 1.00 14.34 N ATOM 1674 CA TYR A 111 -21.120 -16.954 -48.251 1.00 51.25 C ATOM 1675 C TYR A 111 -20.458 -18.300 -47.912 1.00 15.01 C ATOM 1676 O TYR A 111 -21.163 -19.286 -47.683 1.00 51.22 O ATOM 1677 CB TYR A 111 -20.683 -16.466 -49.651 1.00 51.01 C ATOM 1678 CG TYR A 111 -21.456 -15.260 -50.160 1.00 1.55 C ATOM 1679 CD1 TYR A 111 -22.756 -15.394 -50.641 1.00 14.33 C ATOM 1680 CD2 TYR A 111 -20.891 -13.987 -50.149 1.00 62.24 C ATOM 1681 CE1 TYR A 111 -23.466 -14.299 -51.096 1.00 51.32 C ATOM 1682 CE2 TYR A 111 -21.597 -12.889 -50.605 1.00 42.35 C ATOM 1683 CZ TYR A 111 -22.883 -13.051 -51.075 1.00 75.40 C ATOM 1684 OH TYR A 111 -23.593 -11.959 -51.525 1.00 34.13 O ATOM 0 H TYR A 111 -19.934 -16.044 -46.770 1.00 14.34 H new ATOM 0 HA TYR A 111 -22.199 -17.104 -48.274 1.00 51.25 H new ATOM 0 HB2 TYR A 111 -19.622 -16.218 -49.622 1.00 51.01 H new ATOM 0 HB3 TYR A 111 -20.799 -17.284 -50.361 1.00 51.01 H new ATOM 0 HD1 TYR A 111 -23.217 -16.370 -50.659 1.00 14.33 H new ATOM 0 HD2 TYR A 111 -19.885 -13.855 -49.778 1.00 62.24 H new ATOM 0 HE1 TYR A 111 -24.473 -14.421 -51.466 1.00 51.32 H new ATOM 0 HE2 TYR A 111 -21.143 -11.909 -50.593 1.00 42.35 H new ATOM 0 HH TYR A 111 -24.373 -12.263 -52.035 1.00 34.13 H new ATOM 1694 N PRO A 112 -19.105 -18.382 -47.844 1.00 71.14 N ATOM 1695 CA PRO A 112 -18.409 -19.656 -47.661 1.00 74.05 C ATOM 1696 C PRO A 112 -18.322 -20.055 -46.185 1.00 44.53 C ATOM 1697 O PRO A 112 -18.095 -19.205 -45.328 1.00 35.22 O ATOM 1698 CB PRO A 112 -16.996 -19.384 -48.234 1.00 3.14 C ATOM 1699 CG PRO A 112 -16.957 -17.918 -48.577 1.00 55.31 C ATOM 1700 CD PRO A 112 -18.138 -17.277 -47.896 1.00 34.32 C ATOM 0 HA PRO A 112 -18.926 -20.480 -48.153 1.00 74.05 H new ATOM 0 HB2 PRO A 112 -16.225 -19.634 -47.505 1.00 3.14 H new ATOM 0 HB3 PRO A 112 -16.810 -19.995 -49.117 1.00 3.14 H new ATOM 0 HG2 PRO A 112 -16.024 -17.467 -48.238 1.00 55.31 H new ATOM 0 HG3 PRO A 112 -17.008 -17.773 -49.656 1.00 55.31 H new ATOM 0 HD2 PRO A 112 -17.885 -16.911 -46.901 1.00 34.32 H new ATOM 0 HD3 PRO A 112 -18.521 -16.427 -48.461 1.00 34.32 H new ATOM 1708 N PRO A 113 -18.477 -21.359 -45.868 1.00 75.52 N ATOM 1709 CA PRO A 113 -18.387 -21.858 -44.484 1.00 14.13 C ATOM 1710 C PRO A 113 -17.030 -21.538 -43.853 1.00 51.33 C ATOM 1711 O PRO A 113 -16.893 -21.497 -42.631 1.00 50.55 O ATOM 1712 CB PRO A 113 -18.586 -23.379 -44.627 1.00 71.32 C ATOM 1713 CG PRO A 113 -18.322 -23.672 -46.068 1.00 43.15 C ATOM 1714 CD PRO A 113 -18.755 -22.447 -46.824 1.00 14.23 C ATOM 0 HA PRO A 113 -19.124 -21.393 -43.829 1.00 14.13 H new ATOM 0 HB2 PRO A 113 -17.901 -23.929 -43.981 1.00 71.32 H new ATOM 0 HB3 PRO A 113 -19.597 -23.673 -44.344 1.00 71.32 H new ATOM 0 HG2 PRO A 113 -17.266 -23.882 -46.237 1.00 43.15 H new ATOM 0 HG3 PRO A 113 -18.878 -24.550 -46.396 1.00 43.15 H new ATOM 0 HD2 PRO A 113 -18.195 -22.324 -47.751 1.00 14.23 H new ATOM 0 HD3 PRO A 113 -19.810 -22.489 -47.093 1.00 14.23 H new ATOM 1722 N VAL A 114 -16.034 -21.308 -44.707 1.00 63.42 N ATOM 1723 CA VAL A 114 -14.703 -20.914 -44.255 1.00 23.21 C ATOM 1724 C VAL A 114 -14.777 -19.591 -43.492 1.00 74.31 C ATOM 1725 O VAL A 114 -14.049 -19.374 -42.522 1.00 2.15 O ATOM 1726 CB VAL A 114 -13.722 -20.771 -45.448 1.00 34.22 C ATOM 1727 CG1 VAL A 114 -12.308 -20.442 -44.963 1.00 33.32 C ATOM 1728 CG2 VAL A 114 -13.723 -22.039 -46.302 1.00 53.14 C ATOM 0 H VAL A 114 -16.126 -21.388 -45.720 1.00 63.42 H new ATOM 0 HA VAL A 114 -14.330 -21.697 -43.595 1.00 23.21 H new ATOM 0 HB VAL A 114 -14.063 -19.941 -46.067 1.00 34.22 H new ATOM 0 HG11 VAL A 114 -11.642 -20.348 -45.821 1.00 33.32 H new ATOM 0 HG12 VAL A 114 -12.322 -19.503 -44.410 1.00 33.32 H new ATOM 0 HG13 VAL A 114 -11.951 -21.241 -44.313 1.00 33.32 H new ATOM 0 HG21 VAL A 114 -13.029 -21.918 -47.133 1.00 53.14 H new ATOM 0 HG22 VAL A 114 -13.415 -22.888 -45.692 1.00 53.14 H new ATOM 0 HG23 VAL A 114 -14.726 -22.216 -46.690 1.00 53.14 H new ATOM 1738 N ILE A 115 -15.673 -18.715 -43.939 1.00 51.04 N ATOM 1739 CA ILE A 115 -15.911 -17.431 -43.289 1.00 15.41 C ATOM 1740 C ILE A 115 -17.398 -17.306 -42.950 1.00 5.40 C ATOM 1741 O ILE A 115 -18.201 -16.898 -43.792 1.00 35.31 O ATOM 1742 CB ILE A 115 -15.471 -16.236 -44.183 1.00 64.33 C ATOM 1743 CG1 ILE A 115 -13.979 -16.356 -44.557 1.00 53.33 C ATOM 1744 CG2 ILE A 115 -15.748 -14.902 -43.483 1.00 50.30 C ATOM 1745 CD1 ILE A 115 -13.038 -16.326 -43.366 1.00 54.20 C ATOM 0 H ILE A 115 -16.254 -18.876 -44.762 1.00 51.04 H new ATOM 0 HA ILE A 115 -15.312 -17.396 -42.379 1.00 15.41 H new ATOM 0 HB ILE A 115 -16.057 -16.265 -45.102 1.00 64.33 H new ATOM 0 HG12 ILE A 115 -13.826 -17.286 -45.104 1.00 53.33 H new ATOM 0 HG13 ILE A 115 -13.718 -15.542 -45.233 1.00 53.33 H new ATOM 0 HG21 ILE A 115 -15.432 -14.081 -44.127 1.00 50.30 H new ATOM 0 HG22 ILE A 115 -16.815 -14.813 -43.278 1.00 50.30 H new ATOM 0 HG23 ILE A 115 -15.194 -14.861 -42.545 1.00 50.30 H new ATOM 0 HD11 ILE A 115 -12.009 -16.415 -43.713 1.00 54.20 H new ATOM 0 HD12 ILE A 115 -13.160 -15.385 -42.830 1.00 54.20 H new ATOM 0 HD13 ILE A 115 -13.269 -17.156 -42.699 1.00 54.20 H new ATOM 1757 N PRO A 116 -17.784 -17.704 -41.720 1.00 1.54 N ATOM 1758 CA PRO A 116 -19.187 -17.686 -41.274 1.00 4.42 C ATOM 1759 C PRO A 116 -19.860 -16.323 -41.492 1.00 1.54 C ATOM 1760 O PRO A 116 -19.206 -15.285 -41.403 1.00 44.24 O ATOM 1761 CB PRO A 116 -19.086 -18.004 -39.773 1.00 0.11 C ATOM 1762 CG PRO A 116 -17.820 -18.781 -39.641 1.00 2.34 C ATOM 1763 CD PRO A 116 -16.878 -18.205 -40.665 1.00 73.41 C ATOM 0 HA PRO A 116 -19.800 -18.392 -41.835 1.00 4.42 H new ATOM 0 HB2 PRO A 116 -19.057 -17.093 -39.175 1.00 0.11 H new ATOM 0 HB3 PRO A 116 -19.944 -18.582 -39.431 1.00 0.11 H new ATOM 0 HG2 PRO A 116 -17.408 -18.690 -38.636 1.00 2.34 H new ATOM 0 HG3 PRO A 116 -17.992 -19.842 -39.821 1.00 2.34 H new ATOM 0 HD2 PRO A 116 -16.269 -17.405 -40.245 1.00 73.41 H new ATOM 0 HD3 PRO A 116 -16.192 -18.960 -41.049 1.00 73.41 H new ATOM 1771 N PRO A 117 -21.177 -16.317 -41.780 1.00 32.11 N ATOM 1772 CA PRO A 117 -21.944 -15.076 -41.970 1.00 23.42 C ATOM 1773 C PRO A 117 -21.907 -14.199 -40.718 1.00 61.41 C ATOM 1774 O PRO A 117 -21.756 -14.709 -39.602 1.00 22.34 O ATOM 1775 CB PRO A 117 -23.374 -15.571 -42.256 1.00 44.33 C ATOM 1776 CG PRO A 117 -23.411 -16.970 -41.739 1.00 52.33 C ATOM 1777 CD PRO A 117 -22.023 -17.513 -41.933 1.00 32.41 C ATOM 0 HA PRO A 117 -21.542 -14.455 -42.770 1.00 23.42 H new ATOM 0 HB2 PRO A 117 -24.115 -14.946 -41.757 1.00 44.33 H new ATOM 0 HB3 PRO A 117 -23.597 -15.539 -43.323 1.00 44.33 H new ATOM 0 HG2 PRO A 117 -23.696 -16.991 -40.687 1.00 52.33 H new ATOM 0 HG3 PRO A 117 -24.144 -17.568 -42.280 1.00 52.33 H new ATOM 0 HD2 PRO A 117 -21.781 -18.276 -41.194 1.00 32.41 H new ATOM 0 HD3 PRO A 117 -21.902 -17.971 -42.915 1.00 32.41 H new ATOM 1785 N LYS A 118 -22.062 -12.888 -40.906 1.00 12.23 N ATOM 1786 CA LYS A 118 -21.953 -11.926 -39.809 1.00 22.13 C ATOM 1787 C LYS A 118 -20.575 -12.014 -39.158 1.00 41.51 C ATOM 1788 O LYS A 118 -20.448 -12.167 -37.940 1.00 20.11 O ATOM 1789 CB LYS A 118 -23.078 -12.139 -38.782 1.00 64.12 C ATOM 1790 CG LYS A 118 -24.371 -11.407 -39.135 1.00 0.22 C ATOM 1791 CD LYS A 118 -25.562 -11.919 -38.333 1.00 12.22 C ATOM 1792 CE LYS A 118 -26.108 -13.211 -38.923 1.00 54.44 C ATOM 1793 NZ LYS A 118 -26.608 -13.005 -40.310 1.00 73.32 N ATOM 0 H LYS A 118 -22.264 -12.466 -41.813 1.00 12.23 H new ATOM 0 HA LYS A 118 -22.067 -10.921 -40.215 1.00 22.13 H new ATOM 0 HB2 LYS A 118 -23.285 -13.206 -38.698 1.00 64.12 H new ATOM 0 HB3 LYS A 118 -22.735 -11.803 -37.804 1.00 64.12 H new ATOM 0 HG2 LYS A 118 -24.244 -10.340 -38.952 1.00 0.22 H new ATOM 0 HG3 LYS A 118 -24.574 -11.526 -40.199 1.00 0.22 H new ATOM 0 HD2 LYS A 118 -25.262 -12.087 -37.299 1.00 12.22 H new ATOM 0 HD3 LYS A 118 -26.347 -11.162 -38.319 1.00 12.22 H new ATOM 0 HE2 LYS A 118 -25.326 -13.971 -38.925 1.00 54.44 H new ATOM 0 HE3 LYS A 118 -26.916 -13.587 -38.295 1.00 54.44 H new ATOM 0 HZ1 LYS A 118 -27.478 -13.558 -40.451 1.00 73.32 H new ATOM 0 HZ2 LYS A 118 -26.811 -11.996 -40.460 1.00 73.32 H new ATOM 0 HZ3 LYS A 118 -25.885 -13.317 -40.990 1.00 73.32 H new ATOM 1807 N ALA A 119 -19.546 -11.907 -39.990 1.00 25.12 N ATOM 1808 CA ALA A 119 -18.164 -11.988 -39.527 1.00 55.24 C ATOM 1809 C ALA A 119 -17.461 -10.640 -39.656 1.00 12.24 C ATOM 1810 O ALA A 119 -17.555 -9.976 -40.690 1.00 74.12 O ATOM 1811 CB ALA A 119 -17.401 -13.052 -40.309 1.00 71.50 C ATOM 0 H ALA A 119 -19.643 -11.763 -40.995 1.00 25.12 H new ATOM 0 HA ALA A 119 -18.181 -12.266 -38.473 1.00 55.24 H new ATOM 0 HB1 ALA A 119 -16.373 -13.099 -39.951 1.00 71.50 H new ATOM 0 HB2 ALA A 119 -17.879 -14.021 -40.167 1.00 71.50 H new ATOM 0 HB3 ALA A 119 -17.405 -12.797 -41.369 1.00 71.50 H new ATOM 1817 N THR A 120 -16.780 -10.235 -38.590 1.00 51.12 N ATOM 1818 CA THR A 120 -15.951 -9.038 -38.601 1.00 71.23 C ATOM 1819 C THR A 120 -14.580 -9.375 -39.193 1.00 20.24 C ATOM 1820 O THR A 120 -13.947 -10.353 -38.786 1.00 3.02 O ATOM 1821 CB THR A 120 -15.791 -8.472 -37.169 1.00 65.31 C ATOM 1822 OG1 THR A 120 -17.086 -8.191 -36.611 1.00 65.31 O ATOM 1823 CG2 THR A 120 -14.947 -7.201 -37.156 1.00 44.33 C ATOM 0 H THR A 120 -16.788 -10.727 -37.696 1.00 51.12 H new ATOM 0 HA THR A 120 -16.434 -8.277 -39.215 1.00 71.23 H new ATOM 0 HB THR A 120 -15.279 -9.225 -36.569 1.00 65.31 H new ATOM 0 HG1 THR A 120 -16.981 -7.835 -35.704 1.00 65.31 H new ATOM 0 HG21 THR A 120 -14.858 -6.834 -36.134 1.00 44.33 H new ATOM 0 HG22 THR A 120 -13.955 -7.419 -37.551 1.00 44.33 H new ATOM 0 HG23 THR A 120 -15.425 -6.441 -37.774 1.00 44.33 H new ATOM 1831 N LEU A 121 -14.127 -8.572 -40.150 1.00 2.41 N ATOM 1832 CA LEU A 121 -12.900 -8.872 -40.890 1.00 73.03 C ATOM 1833 C LEU A 121 -11.918 -7.708 -40.752 1.00 70.13 C ATOM 1834 O LEU A 121 -12.329 -6.546 -40.724 1.00 70.31 O ATOM 1835 CB LEU A 121 -13.251 -9.141 -42.371 1.00 5.25 C ATOM 1836 CG LEU A 121 -12.287 -10.060 -43.158 1.00 44.23 C ATOM 1837 CD1 LEU A 121 -10.950 -9.377 -43.430 1.00 63.11 C ATOM 1838 CD2 LEU A 121 -12.076 -11.378 -42.413 1.00 11.54 C ATOM 0 H LEU A 121 -14.589 -7.708 -40.434 1.00 2.41 H new ATOM 0 HA LEU A 121 -12.424 -9.764 -40.482 1.00 73.03 H new ATOM 0 HB2 LEU A 121 -14.248 -9.580 -42.410 1.00 5.25 H new ATOM 0 HB3 LEU A 121 -13.305 -8.183 -42.887 1.00 5.25 H new ATOM 0 HG LEU A 121 -12.748 -10.272 -44.123 1.00 44.23 H new ATOM 0 HD11 LEU A 121 -10.301 -10.055 -43.985 1.00 63.11 H new ATOM 0 HD12 LEU A 121 -11.116 -8.473 -44.016 1.00 63.11 H new ATOM 0 HD13 LEU A 121 -10.476 -9.114 -42.484 1.00 63.11 H new ATOM 0 HD21 LEU A 121 -11.395 -12.012 -42.981 1.00 11.54 H new ATOM 0 HD22 LEU A 121 -11.649 -11.176 -41.430 1.00 11.54 H new ATOM 0 HD23 LEU A 121 -13.033 -11.887 -42.296 1.00 11.54 H new ATOM 1850 N VAL A 122 -10.624 -8.014 -40.661 1.00 31.41 N ATOM 1851 CA VAL A 122 -9.612 -6.985 -40.482 1.00 43.23 C ATOM 1852 C VAL A 122 -8.939 -6.684 -41.816 1.00 70.11 C ATOM 1853 O VAL A 122 -8.297 -7.547 -42.404 1.00 44.44 O ATOM 1854 CB VAL A 122 -8.546 -7.420 -39.444 1.00 61.11 C ATOM 1855 CG1 VAL A 122 -7.480 -6.340 -39.279 1.00 50.24 C ATOM 1856 CG2 VAL A 122 -9.199 -7.754 -38.102 1.00 74.23 C ATOM 0 H VAL A 122 -10.257 -8.965 -40.709 1.00 31.41 H new ATOM 0 HA VAL A 122 -10.104 -6.087 -40.109 1.00 43.23 H new ATOM 0 HB VAL A 122 -8.058 -8.322 -39.814 1.00 61.11 H new ATOM 0 HG11 VAL A 122 -6.742 -6.666 -38.546 1.00 50.24 H new ATOM 0 HG12 VAL A 122 -6.988 -6.165 -40.236 1.00 50.24 H new ATOM 0 HG13 VAL A 122 -7.947 -5.417 -38.937 1.00 50.24 H new ATOM 0 HG21 VAL A 122 -8.432 -8.057 -37.389 1.00 74.23 H new ATOM 0 HG22 VAL A 122 -9.720 -6.875 -37.722 1.00 74.23 H new ATOM 0 HG23 VAL A 122 -9.911 -8.568 -38.236 1.00 74.23 H new ATOM 1866 N PHE A 123 -9.097 -5.467 -42.305 1.00 33.02 N ATOM 1867 CA PHE A 123 -8.498 -5.079 -43.572 1.00 14.15 C ATOM 1868 C PHE A 123 -7.354 -4.108 -43.333 1.00 24.01 C ATOM 1869 O PHE A 123 -7.557 -3.012 -42.803 1.00 14.25 O ATOM 1870 CB PHE A 123 -9.542 -4.432 -44.499 1.00 30.11 C ATOM 1871 CG PHE A 123 -10.554 -5.403 -45.063 1.00 10.14 C ATOM 1872 CD1 PHE A 123 -10.309 -6.063 -46.259 1.00 52.10 C ATOM 1873 CD2 PHE A 123 -11.751 -5.645 -44.403 1.00 51.11 C ATOM 1874 CE1 PHE A 123 -11.236 -6.945 -46.783 1.00 34.12 C ATOM 1875 CE2 PHE A 123 -12.681 -6.525 -44.926 1.00 23.22 C ATOM 1876 CZ PHE A 123 -12.424 -7.174 -46.116 1.00 24.21 C ATOM 0 H PHE A 123 -9.634 -4.731 -41.846 1.00 33.02 H new ATOM 0 HA PHE A 123 -8.115 -5.978 -44.055 1.00 14.15 H new ATOM 0 HB2 PHE A 123 -10.070 -3.654 -43.947 1.00 30.11 H new ATOM 0 HB3 PHE A 123 -9.025 -3.942 -45.324 1.00 30.11 H new ATOM 0 HD1 PHE A 123 -9.383 -5.886 -46.787 1.00 52.10 H new ATOM 0 HD2 PHE A 123 -11.958 -5.141 -43.471 1.00 51.11 H new ATOM 0 HE1 PHE A 123 -11.032 -7.455 -47.713 1.00 34.12 H new ATOM 0 HE2 PHE A 123 -13.609 -6.704 -44.403 1.00 23.22 H new ATOM 0 HZ PHE A 123 -13.151 -7.860 -46.526 1.00 24.21 H new ATOM 1886 N GLU A 124 -6.148 -4.522 -43.694 1.00 64.31 N ATOM 1887 CA GLU A 124 -5.026 -3.605 -43.714 1.00 51.31 C ATOM 1888 C GLU A 124 -5.121 -2.766 -44.980 1.00 24.30 C ATOM 1889 O GLU A 124 -4.912 -3.260 -46.093 1.00 64.22 O ATOM 1890 CB GLU A 124 -3.686 -4.350 -43.633 1.00 15.04 C ATOM 1891 CG GLU A 124 -3.429 -4.983 -42.265 1.00 23.21 C ATOM 1892 CD GLU A 124 -2.030 -5.569 -42.128 1.00 12.02 C ATOM 1893 OE1 GLU A 124 -1.050 -4.827 -42.357 1.00 32.21 O ATOM 1894 OE2 GLU A 124 -1.909 -6.762 -41.782 1.00 21.31 O ATOM 0 H GLU A 124 -5.926 -5.477 -43.974 1.00 64.31 H new ATOM 0 HA GLU A 124 -5.067 -2.957 -42.839 1.00 51.31 H new ATOM 0 HB2 GLU A 124 -3.664 -5.128 -44.396 1.00 15.04 H new ATOM 0 HB3 GLU A 124 -2.878 -3.656 -43.862 1.00 15.04 H new ATOM 0 HG2 GLU A 124 -3.578 -4.231 -41.490 1.00 23.21 H new ATOM 0 HG3 GLU A 124 -4.164 -5.769 -42.092 1.00 23.21 H new ATOM 1901 N VAL A 125 -5.492 -1.510 -44.793 1.00 22.33 N ATOM 1902 CA VAL A 125 -5.716 -0.579 -45.888 1.00 0.42 C ATOM 1903 C VAL A 125 -4.479 0.286 -46.102 1.00 41.00 C ATOM 1904 O VAL A 125 -3.746 0.567 -45.155 1.00 20.15 O ATOM 1905 CB VAL A 125 -6.955 0.310 -45.607 1.00 20.05 C ATOM 1906 CG1 VAL A 125 -8.239 -0.511 -45.721 1.00 34.15 C ATOM 1907 CG2 VAL A 125 -6.860 0.953 -44.222 1.00 11.44 C ATOM 0 H VAL A 125 -5.647 -1.104 -43.870 1.00 22.33 H new ATOM 0 HA VAL A 125 -5.906 -1.152 -46.796 1.00 0.42 H new ATOM 0 HB VAL A 125 -6.979 1.104 -46.354 1.00 20.05 H new ATOM 0 HG11 VAL A 125 -9.099 0.128 -45.521 1.00 34.15 H new ATOM 0 HG12 VAL A 125 -8.319 -0.923 -46.727 1.00 34.15 H new ATOM 0 HG13 VAL A 125 -8.216 -1.325 -44.997 1.00 34.15 H new ATOM 0 HG21 VAL A 125 -7.740 1.572 -44.047 1.00 11.44 H new ATOM 0 HG22 VAL A 125 -6.808 0.174 -43.462 1.00 11.44 H new ATOM 0 HG23 VAL A 125 -5.965 1.572 -44.169 1.00 11.44 H new ATOM 1917 N GLU A 126 -4.245 0.698 -47.342 1.00 43.13 N ATOM 1918 CA GLU A 126 -3.031 1.432 -47.694 1.00 63.02 C ATOM 1919 C GLU A 126 -3.309 2.436 -48.811 1.00 75.21 C ATOM 1920 O GLU A 126 -3.930 2.093 -49.815 1.00 73.13 O ATOM 1921 CB GLU A 126 -1.954 0.430 -48.125 1.00 51.44 C ATOM 1922 CG GLU A 126 -0.657 1.059 -48.620 1.00 43.20 C ATOM 1923 CD GLU A 126 0.394 0.017 -48.973 1.00 3.30 C ATOM 1924 OE1 GLU A 126 0.014 -1.127 -49.315 1.00 32.43 O ATOM 1925 OE2 GLU A 126 1.598 0.324 -48.885 1.00 33.31 O ATOM 0 H GLU A 126 -4.880 0.537 -48.124 1.00 43.13 H new ATOM 0 HA GLU A 126 -2.683 1.992 -46.826 1.00 63.02 H new ATOM 0 HB2 GLU A 126 -1.726 -0.222 -47.282 1.00 51.44 H new ATOM 0 HB3 GLU A 126 -2.360 -0.201 -48.916 1.00 51.44 H new ATOM 0 HG2 GLU A 126 -0.865 1.673 -49.496 1.00 43.20 H new ATOM 0 HG3 GLU A 126 -0.262 1.724 -47.852 1.00 43.20 H new ATOM 1932 N LEU A 127 -2.861 3.674 -48.626 1.00 44.31 N ATOM 1933 CA LEU A 127 -3.026 4.718 -49.638 1.00 71.21 C ATOM 1934 C LEU A 127 -1.704 4.942 -50.374 1.00 21.13 C ATOM 1935 O LEU A 127 -0.729 5.411 -49.784 1.00 72.31 O ATOM 1936 CB LEU A 127 -3.515 6.023 -48.973 1.00 2.35 C ATOM 1937 CG LEU A 127 -4.015 7.147 -49.913 1.00 62.44 C ATOM 1938 CD1 LEU A 127 -2.857 7.863 -50.602 1.00 31.13 C ATOM 1939 CD2 LEU A 127 -4.999 6.598 -50.945 1.00 41.12 C ATOM 0 H LEU A 127 -2.379 3.982 -47.782 1.00 44.31 H new ATOM 0 HA LEU A 127 -3.775 4.403 -50.365 1.00 71.21 H new ATOM 0 HB2 LEU A 127 -4.323 5.771 -48.287 1.00 2.35 H new ATOM 0 HB3 LEU A 127 -2.699 6.423 -48.371 1.00 2.35 H new ATOM 0 HG LEU A 127 -4.535 7.879 -49.295 1.00 62.44 H new ATOM 0 HD11 LEU A 127 -3.248 8.645 -51.253 1.00 31.13 H new ATOM 0 HD12 LEU A 127 -2.206 8.309 -49.850 1.00 31.13 H new ATOM 0 HD13 LEU A 127 -2.288 7.147 -51.196 1.00 31.13 H new ATOM 0 HD21 LEU A 127 -5.336 7.407 -51.593 1.00 41.12 H new ATOM 0 HD22 LEU A 127 -4.507 5.833 -51.545 1.00 41.12 H new ATOM 0 HD23 LEU A 127 -5.857 6.162 -50.434 1.00 41.12 H new ATOM 1951 N LEU A 128 -1.672 4.597 -51.660 1.00 14.43 N ATOM 1952 CA LEU A 128 -0.475 4.783 -52.482 1.00 30.41 C ATOM 1953 C LEU A 128 -0.504 6.151 -53.159 1.00 2.23 C ATOM 1954 O LEU A 128 0.513 6.842 -53.232 1.00 15.42 O ATOM 1955 CB LEU A 128 -0.352 3.679 -53.549 1.00 73.21 C ATOM 1956 CG LEU A 128 -0.109 2.251 -53.020 1.00 25.15 C ATOM 1957 CD1 LEU A 128 1.098 2.213 -52.087 1.00 61.42 C ATOM 1958 CD2 LEU A 128 -1.354 1.696 -52.329 1.00 51.52 C ATOM 0 H LEU A 128 -2.462 4.186 -52.157 1.00 14.43 H new ATOM 0 HA LEU A 128 0.392 4.723 -51.824 1.00 30.41 H new ATOM 0 HB2 LEU A 128 -1.265 3.674 -54.145 1.00 73.21 H new ATOM 0 HB3 LEU A 128 0.466 3.940 -54.221 1.00 73.21 H new ATOM 0 HG LEU A 128 0.106 1.612 -53.876 1.00 25.15 H new ATOM 0 HD11 LEU A 128 1.248 1.195 -51.728 1.00 61.42 H new ATOM 0 HD12 LEU A 128 1.986 2.542 -52.627 1.00 61.42 H new ATOM 0 HD13 LEU A 128 0.923 2.875 -51.239 1.00 61.42 H new ATOM 0 HD21 LEU A 128 -1.151 0.688 -51.967 1.00 51.52 H new ATOM 0 HD22 LEU A 128 -1.619 2.337 -51.488 1.00 51.52 H new ATOM 0 HD23 LEU A 128 -2.181 1.667 -53.038 1.00 51.52 H new ATOM 1970 N ALA A 129 -1.678 6.535 -53.649 1.00 4.43 N ATOM 1971 CA ALA A 129 -1.863 7.818 -54.323 1.00 1.24 C ATOM 1972 C ALA A 129 -3.276 8.332 -54.082 1.00 55.22 C ATOM 1973 O ALA A 129 -4.233 7.557 -54.096 1.00 1.51 O ATOM 1974 CB ALA A 129 -1.587 7.683 -55.817 1.00 14.11 C ATOM 0 H ALA A 129 -2.525 5.970 -53.591 1.00 4.43 H new ATOM 0 HA ALA A 129 -1.154 8.537 -53.912 1.00 1.24 H new ATOM 0 HB1 ALA A 129 -1.730 8.649 -56.302 1.00 14.11 H new ATOM 0 HB2 ALA A 129 -0.561 7.349 -55.969 1.00 14.11 H new ATOM 0 HB3 ALA A 129 -2.273 6.955 -56.249 1.00 14.11 H new ATOM 1980 N VAL A 130 -3.399 9.630 -53.842 1.00 71.35 N ATOM 1981 CA VAL A 130 -4.695 10.250 -53.588 1.00 3.33 C ATOM 1982 C VAL A 130 -4.908 11.444 -54.523 1.00 10.44 C ATOM 1983 O VAL A 130 -4.202 12.464 -54.384 1.00 70.32 O ATOM 1984 CB VAL A 130 -4.857 10.664 -52.094 1.00 20.24 C ATOM 1985 CG1 VAL A 130 -3.679 11.513 -51.604 1.00 51.34 C ATOM 1986 CG2 VAL A 130 -6.183 11.393 -51.874 1.00 32.12 C ATOM 1987 OXT VAL A 130 -5.766 11.346 -55.423 1.00 0.00 O ATOM 0 H VAL A 130 -2.612 10.279 -53.818 1.00 71.35 H new ATOM 0 HA VAL A 130 -5.466 9.508 -53.796 1.00 3.33 H new ATOM 0 HB VAL A 130 -4.863 9.749 -51.502 1.00 20.24 H new ATOM 0 HG11 VAL A 130 -3.833 11.779 -50.558 1.00 51.34 H new ATOM 0 HG12 VAL A 130 -2.755 10.943 -51.701 1.00 51.34 H new ATOM 0 HG13 VAL A 130 -3.611 12.421 -52.203 1.00 51.34 H new ATOM 0 HG21 VAL A 130 -6.275 11.673 -50.824 1.00 32.12 H new ATOM 0 HG22 VAL A 130 -6.212 12.290 -52.492 1.00 32.12 H new ATOM 0 HG23 VAL A 130 -7.009 10.737 -52.148 1.00 32.12 H new TER 1997 VAL A 130